6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane

C190H314N8OS — CID 162193228

IUPAC6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)c1cc2c(cc1C(C)C)CCC=C2.CC(C)c1cc2c(cc1C(C)C)OCC=C2.CC(C)c1cc2c(cc1C(C)C)SCC=C2.CC(C)c1cc2ccccc2cc1C(C)C.CC(C)c1cc2ccccc2nc1C(C)C.CC(C)c1cc2ccccc2nc1C(C)C.CC(C)c1cc2cccnc2cc1C(C)C.CC(C)c1cc2ccncc2cc1C(C)C.CC(C)c1cc2cncnc2cc1C(C)C.CC(C)c1cc2cncnc2cc1C(C)C
InChIInChI=1S/C16H22.C16H20.4C15H19N.C15H20O.C15H20S.2C14H18N2.20C2H6/c2*1-11(2)15-9-13-7-5-6-8-14(13)10-16(15)12(3)4;1-10(2)14-7-12-5-6-16-9-13(12)8-15(14)11(3)4;1-10(2)13-8-12-6-5-7-16-15(12)9-14(13)11(3)4;2*1-10(2)13-9-12-7-5-6-8-14(12)16-15(13)11(3)4;2*1-10(2)13-8-12-6-5-7-16-15(12)9-14(13)11(3)4;2*1-9(2)12-5-11-7-15-8-16-14(11)6-13(12)10(3)4;20*1-2/h5,7,9-12H,6,8H2,1-4H3;5-12H,1-4H3;4*5-11H,1-4H3;2*5-6,8-11H,7H2,1-4H3;2*5-10H,1-4H3;20*1-2H3
InChIKeyZQPCHPVQMZYVSY-UHFFFAOYSA-N
MW2758.72 g/mol
LogP65.57
Rot. Bonds20

About 6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane

6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane (PubChem CID 162193228) has the molecular formula C190H314N8OS and a molecular weight of 2758.72 g/mol. Its IUPAC name is 6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane.

Molecular Properties

Compound Name6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane
PubChem CID162193228
Molecular FormulaC190H314N8OS
Molecular Weight2758.72 g/mol
Exact Mass2756.45
IUPAC Name6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)c1cc2c(cc1C(C)C)CCC=C2.CC(C)c1cc2c(cc1C(C)C)OCC=C2.CC(C)c1cc2c(cc1C(C)C)SCC=C2.CC(C)c1cc2ccccc2cc1C(C)C.CC(C)c1cc2ccccc2nc1C(C)C.CC(C)c1cc2ccccc2nc1C(C)C.CC(C)c1cc2cccnc2cc1C(C)C.CC(C)c1cc2ccncc2cc1C(C)C.CC(C)c1cc2cncnc2cc1C(C)C.CC(C)c1cc2cncnc2cc1C(C)C
InChIInChI=1S/C16H22.C16H20.4C15H19N.C15H20O.C15H20S.2C14H18N2.20C2H6/c2*1-11(2)15-9-13-7-5-6-8-14(13)10-16(15)12(3)4;1-10(2)14-7-12-5-6-16-9-13(12)8-15(14)11(3)4;1-10(2)13-8-12-6-5-7-16-15(12)9-14(13)11(3)4;2*1-10(2)13-9-12-7-5-6-8-14(12)16-15(13)11(3)4;2*1-10(2)13-8-12-6-5-7-16-15(12)9-14(13)11(3)4;2*1-9(2)12-5-11-7-15-8-16-14(11)6-13(12)10(3)4;20*1-2/h5,7,9-12H,6,8H2,1-4H3;5-12H,1-4H3;4*5-11H,1-4H3;2*5-6,8-11H,7H2,1-4H3;2*5-10H,1-4H3;20*1-2H3
InChIKeyZQPCHPVQMZYVSY-UHFFFAOYSA-N
XLogP65.57
TPSA112.35 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds20
Heavy Atoms200
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002758.72
LogP ≤ 565.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane with MolForge

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Related Compounds

4-N-(3-fluoro-4-isoquinolin-5-yloxyphenyl)-6-methylpyrimidine-2,4-diamine;4-N-(4-isoquinolin-5-yloxyphenyl)-6-methylpyrimidine-2,4-diamine;6-methyl-4-N-[4-(2-pyridin-4-ylethyl)phenyl]pyrimidine-2,4-diamine;6-methyl-4-N-[4-(pyridin-4-ylmethylsulfanyl)phenyl]pyrimidine-2,4-diamine;6-methyl-4-N-[4-(pyridin-4-ylsulfanylmethyl)phenyl]pyrimidine-2,4-diamine;6-methyl-4-N-[4-pyridin-4-ylsulfanyl-3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 158118686
4-N-(3-fluoro-4-isoquinolin-5-yloxyphenyl)-6-methylpyrimidine-2,4-diamine;4-N-(4-isoquinolin-5-yloxyphenyl)-6-methylpyrimidine-2,4-diamine;6-methyl-4-N-[4-(2-pyridin-4-ylethyl)phenyl]pyrimidine-2,4-diamine;6-methyl-4-N-[4-(pyridin-4-ylsulfanylmethyl)phenyl]pyrimidine-2,4-diamine;6-methyl-4-N-[4-pyridin-4-ylsulfanyl-3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 160697056
CID 161111077
CID 161111077
4-N-(4-isoquinolin-5-yloxyphenyl)-6-methylpyrimidine-2,4-diamine;6-methyl-4-N-[4-(2-pyridin-4-ylethyl)phenyl]pyrimidine-2,4-diamine;6-methyl-4-N-[4-(pyridin-4-ylmethylsulfanyl)phenyl]pyrimidine-2,4-diamine;6-methyl-4-N-[4-(pyridin-4-ylsulfanylmethyl)phenyl]pyrimidine-2,4-diamine;6-methyl-4-N-[4-pyridin-4-ylsulfanyl-3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 161265887
6,9-Dimethyl-18-phenyl-3,5-diaza-9-azoniatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2,4,6,8(13),9,11,15,17-nonaene;18-methoxy-6,9,15-trimethyl-3,5-diaza-9-azoniatetracyclo[12.4.0.02,7.08,13]octadeca-1(18),2,4,6,8(13),9,11,14,16-nonaene;6,9,15,18-tetramethyl-3,5-diaza-9-azoniatetracyclo[12.4.0.02,7.08,13]octadeca-1(18),2,4,6,8(13),9,11,14,16-nonaene;6,9,15-trimethyl-18-propan-2-yl-3,5-diaza-9-azoniatetracyclo[12.4.0.02,7.08,13]octadeca-1(18),2,4,6,8(13),9,11,14,16-nonaene;6,9,15-trimethyl-18-(trifluoromethyl)-3,5-diaza-9-azoniatetracyclo[12.4.0.02,7.08,13]octadeca-1(18),2,4,6,8(13),9,11,14,16-nonaene
CID 161277484
4-N-(3-fluoro-4-isoquinolin-5-yloxyphenyl)-6-methylpyrimidine-2,4-diamine;4-N-(4-isoquinolin-5-yloxyphenyl)-6-methylpyrimidine-2,4-diamine;6-methyl-4-N-[4-(2-pyridin-4-ylethyl)phenyl]pyrimidine-2,4-diamine;6-methyl-4-N-[4-(pyridin-4-ylsulfanylmethyl)phenyl]pyrimidine-2,4-diamine;6-methyl-4-N-[4-pyridin-4-ylsulfanyl-3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine;6-methyl-4-N-(4-quinolin-4-ylsulfanylphenyl)pyrimidine-2,4-diamine
CID 161964264
10-[6,8-Bis(4,6-dipyridin-2-ylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine
CID 129290712
10-[4-Phenothiazin-10-yl-6,8-bis(4-pyridin-2-yl-6-pyridin-3-ylpyrimidin-2-yl)naphthalen-2-yl]phenoxazine
CID 129290713
10-[4-Phenothiazin-10-yl-6,8-bis(6-pyridin-2-yl-2-pyridin-3-ylpyrimidin-4-yl)naphthalen-2-yl]phenoxazine
CID 129290714
10-[4-Phenothiazin-10-yl-6,8-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-2-yl]phenoxazine
CID 129290717
10-[5,7-Bis(4,6-dipyridin-2-ylpyrimidin-2-yl)-3-phenothiazin-10-ylnaphthalen-1-yl]phenoxazine
CID 129290721
10-[3-Phenothiazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine
CID 129290723

Frequently Asked Questions

What is the IUPAC name of 6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane?
The IUPAC name of 6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane (CID 162193228) is 6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane.
What is the SMILES notation for 6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane?
The canonical SMILES for 6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC(C)c1cc2c(cc1C(C)C)CCC=C2.CC(C)c1cc2c(cc1C(C)C)OCC=C2.CC(C)c1cc2c(cc1C(C)C)SCC=C2.CC(C)c1cc2ccccc2cc1C(C)C.CC(C)c1cc2ccccc2nc1C(C)C.CC(C)c1cc2ccccc2nc1C(C)C.CC(C)c1cc2cccnc2cc1C(C)C.CC(C)c1cc2ccncc2cc1C(C)C.CC(C)c1cc2cncnc2cc1C(C)C.CC(C)c1cc2cncnc2cc1C(C)C.
What is the InChIKey of 6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane?
The InChIKey is ZQPCHPVQMZYVSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22.C16H20.4C15H19N.C15H20O.C15H20S.2C14H18N2.20C2H6/c2*1-11(2)15-9-13-7-5-6-8-14(13)10-16(15)12(3)4;1-10(2)14-7-12-5-6-16-9-13(12)8-15(14)11(3)4;1-10(2)13-8-12-6-5-7-16-15(12)9-14(13)11(3)4;2*1-10(2)13-9-12-7-5-6-8-14(12)16-15(13)11(3)4;2*1-10(2)13-8-12-6-5-7-16-15(12)9-14(13)11(3)4;2*1-9(2)12-5-11-7-15-8-16-14(11)6-13(12)10(3)4;20*1-2/h5,7,9-12H,6,8H2,1-4H3;5-12H,1-4H3;4*5-11H,1-4H3;2*5-6,8-11H,7H2,1-4H3;2*5-10H,1-4H3;20*1-2H3.
What are the key properties of 6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane?
6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane has a molecular weight of 2758.72 g/mol, XLogP of 65.57, 20 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-di(propan-2-yl)-2H-chromene;6,7-di(propan-2-yl)-1,2-dihydronaphthalene;6,7-di(propan-2-yl)isoquinoline;2,3-di(propan-2-yl)naphthalene;bis(6,7-di(propan-2-yl)quinazoline);bis(2,3-di(propan-2-yl)quinoline);6,7-di(propan-2-yl)quinoline;6,7-di(propan-2-yl)-2H-thiochromene;ethane is sourced from PubChem (CID 162193228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).