6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine

C95H141ClF5N9O2 — CID 157377628

IUPAC6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine
SMILESCC(C)c1ccc(C(F)(F)F)nc1C(C)C.CC(C)c1ccc(C2CC2)nc1C(C)C.CC(C)c1ccc(Cl)nc1C(C)C.CC(C)c1ccc(F)nc1C(C)C.CC(C)c1ccc(OC2CC2)nc1C(C)C.CC(C)c1cncnc1C(C)C.CC(C)c1nccc(F)c1C(C)C.COc1ccc(C(C)C)c(C(C)C)n1
InChIInChI=1S/C14H21NO.C14H21N.C12H16F3N.C12H19NO.C11H16ClN.2C11H16FN.C10H16N2/c1-9(2)12-7-8-13(16-11-5-6-11)15-14(12)10(3)4;1-9(2)12-7-8-13(11-5-6-11)15-14(12)10(3)4;1-7(2)9-5-6-10(12(13,14)15)16-11(9)8(3)4;1-8(2)10-6-7-11(14-5)13-12(10)9(3)4;1-7(2)9-5-6-10(12)13-11(9)8(3)4;1-7(2)10-9(12)5-6-13-11(10)8(3)4;1-7(2)9-5-6-10(12)13-11(9)8(3)4;1-7(2)9-5-11-6-12-10(9)8(3)4/h7-11H,5-6H2,1-4H3;7-11H,5-6H2,1-4H3;5-8H,1-4H3;6-9H,1-5H3;3*5-8H,1-4H3;5-8H,1-4H3
InChIKeyBKMQWYIZIBXYSR-UHFFFAOYSA-N
MW1571.68 g/mol
LogP29.40
Rot. Bonds20

About 6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine

6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine (PubChem CID 157377628) has the molecular formula C95H141ClF5N9O2 and a molecular weight of 1571.68 g/mol. Its IUPAC name is 6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine.

Molecular Properties

Compound Name6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine
PubChem CID157377628
Molecular FormulaC95H141ClF5N9O2
Molecular Weight1571.68 g/mol
Exact Mass1570.08
IUPAC Name6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine
SMILESCC(C)c1ccc(C(F)(F)F)nc1C(C)C.CC(C)c1ccc(C2CC2)nc1C(C)C.CC(C)c1ccc(Cl)nc1C(C)C.CC(C)c1ccc(F)nc1C(C)C.CC(C)c1ccc(OC2CC2)nc1C(C)C.CC(C)c1cncnc1C(C)C.CC(C)c1nccc(F)c1C(C)C.COc1ccc(C(C)C)c(C(C)C)n1
InChIInChI=1S/C14H21NO.C14H21N.C12H16F3N.C12H19NO.C11H16ClN.2C11H16FN.C10H16N2/c1-9(2)12-7-8-13(16-11-5-6-11)15-14(12)10(3)4;1-9(2)12-7-8-13(11-5-6-11)15-14(12)10(3)4;1-7(2)9-5-6-10(12(13,14)15)16-11(9)8(3)4;1-8(2)10-6-7-11(14-5)13-12(10)9(3)4;1-7(2)9-5-6-10(12)13-11(9)8(3)4;1-7(2)10-9(12)5-6-13-11(10)8(3)4;1-7(2)9-5-6-10(12)13-11(9)8(3)4;1-7(2)9-5-11-6-12-10(9)8(3)4/h7-11H,5-6H2,1-4H3;7-11H,5-6H2,1-4H3;5-8H,1-4H3;6-9H,1-5H3;3*5-8H,1-4H3;5-8H,1-4H3
InChIKeyBKMQWYIZIBXYSR-UHFFFAOYSA-N
XLogP29.40
TPSA134.47 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds20
Heavy Atoms112
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001571.68
LogP ≤ 529.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine with MolForge

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Related Compounds

5-(2-chloro-5-(trifluoromethyl)pyridin-3-yl)-4-(((1S,2S)-2-(5-methoxypyridin-2-yl)cyclopropyl)methoxy)-2-methylpyrimidine
CID 76283028
5-(2-chloro-5-(trifluoromethyl)pyridin-4-yl)-4-(((1S,2S)-2-(5-methoxypyridin-2-yl)cyclopropyl)methoxy)-2-methylpyrimidine
CID 76283029
2-Methoxy-5-[2-[[6-[6-(2,2,2-trifluoroethoxy)pyridin-3-yl]pyridin-2-yl]methyl]phenyl]pyrimidine
CID 118073512
5-(2-chloro-5-methoxypyridin-4-yl)-4-(((1S,2S)-2-(5-methoxypyridin-2-yl)cyclopropyl)methoxy)-2-methylpyrimidine
CID 90182193
5-(6-chloropyridin-3-yl)-4-(((1S,2S)-2-(5-methoxypyridin-2-yl)cyclopropyl)methoxy)-2-methylpyrimidine
CID 76280991
2-[4-[[4-(6-Chloro-2-methyl-3-pyridinyl)-2,6-difluorophenoxy]methyl]piperidin-1-yl]-5-ethylpyrimidine
CID 44608205
4-[2-[[4-[2-(5-Chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]-2,7-naphthyridin-1-yl]oxy]ethyl]morpholine
CID 56592467
2-Methoxy-5-[2-[[6-[6-(3,3,3-trifluoropropoxy)pyridin-3-yl]pyridin-2-yl]methyl]phenyl]pyrimidine
CID 118088049
5-[2-Chloro-5-(trifluoromethyl)-4-pyridinyl]-4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidine
CID 123319375
5-[2-Chloro-5-(trifluoromethyl)-3-pyridinyl]-4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidine
CID 123816789
5-[2-chloro-5-(trifluoromethyl)-4-pyridinyl]-4-[(2S,3S)-3-(5-methoxy-2-pyridinyl)-2-methylbutoxy]-2-methylpyrimidine
CID 129167296
5-[2-chloro-5-(trifluoromethyl)-3-pyridinyl]-4-[(2S,3S)-3-(5-methoxy-2-pyridinyl)-2-methylbutoxy]-2-methylpyrimidine
CID 129167325

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine?
The IUPAC name of 6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine (CID 157377628) is 6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine.
What is the SMILES notation for 6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine?
The canonical SMILES for 6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine is CC(C)c1ccc(C(F)(F)F)nc1C(C)C.CC(C)c1ccc(C2CC2)nc1C(C)C.CC(C)c1ccc(Cl)nc1C(C)C.CC(C)c1ccc(F)nc1C(C)C.CC(C)c1ccc(OC2CC2)nc1C(C)C.CC(C)c1cncnc1C(C)C.CC(C)c1nccc(F)c1C(C)C.COc1ccc(C(C)C)c(C(C)C)n1.
What is the InChIKey of 6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine?
The InChIKey is BKMQWYIZIBXYSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO.C14H21N.C12H16F3N.C12H19NO.C11H16ClN.2C11H16FN.C10H16N2/c1-9(2)12-7-8-13(16-11-5-6-11)15-14(12)10(3)4;1-9(2)12-7-8-13(11-5-6-11)15-14(12)10(3)4;1-7(2)9-5-6-10(12(13,14)15)16-11(9)8(3)4;1-8(2)10-6-7-11(14-5)13-12(10)9(3)4;1-7(2)9-5-6-10(12)13-11(9)8(3)4;1-7(2)10-9(12)5-6-13-11(10)8(3)4;1-7(2)9-5-6-10(12)13-11(9)8(3)4;1-7(2)9-5-11-6-12-10(9)8(3)4/h7-11H,5-6H2,1-4H3;7-11H,5-6H2,1-4H3;5-8H,1-4H3;6-9H,1-5H3;3*5-8H,1-4H3;5-8H,1-4H3.
What are the key properties of 6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine?
6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine has a molecular weight of 1571.68 g/mol, XLogP of 29.40, 20 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2,3-di(propan-2-yl)pyridine;6-cyclopropyl-2,3-di(propan-2-yl)pyridine;6-cyclopropyloxy-2,3-di(propan-2-yl)pyridine;4,5-di(propan-2-yl)pyrimidine;2,3-di(propan-2-yl)-6-(trifluoromethyl)pyridine;4-fluoro-2,3-di(propan-2-yl)pyridine;6-fluoro-2,3-di(propan-2-yl)pyridine;6-methoxy-2,3-di(propan-2-yl)pyridine is sourced from PubChem (CID 157377628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).