(5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine

C14H20N2 — CID 177343084

IUPAC(5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine
SMILESC=CC1=NC(=CC)/C(=C\C(=C)C)C(C)N1C
InChIInChI=1S/C14H20N2/c1-7-13-12(9-10(3)4)11(5)16(6)14(8-2)15-13/h7-9,11H,2-3H2,1,4-6H3/b12-9-,13-7?
InChIKeyBCTMAOIKLTWBTJ-BKHWCZKVSA-N
MW216.33 g/mol
LogP3.31
Rot. Bonds2

About (5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine

(5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine (PubChem CID 177343084) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is (5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine.

Molecular Properties

Compound Name(5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine
PubChem CID177343084
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name(5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine
SMILESC=CC1=NC(=CC)/C(=C\C(=C)C)C(C)N1C
InChIInChI=1S/C14H20N2/c1-7-13-12(9-10(3)4)11(5)16(6)14(8-2)15-13/h7-9,11H,2-3H2,1,4-6H3/b12-9-,13-7?
InChIKeyBCTMAOIKLTWBTJ-BKHWCZKVSA-N
XLogP3.31
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexa-1,3-dien-1-yl-N-methyl-3,4-dihydropyridin-2-amine
CID 57083440
(7Z)-2-[(3Z,5Z)-hepta-1,3,5-trien-2-yl]-1-methyl-4-methylidene-5,6-dihydro-1,3-diazocine
CID 89053548
1-N-butyl-1-(5-chloro-2-methylidene-1-pyridinyl)-2-ethylidene-3-N-methylpent-4-ene-1,3-diimine
CID 91153770
1-ethyl-3,6-dimethyl-3H-pyrido[1,2-c]pyrimidine
CID 123161013
3-(Cyclohexa-1,5-dien-1-ylmethyl)-4-cyclopropylidene-2-methyl-6,7-dihydroquinazoline
CID 123755807
(E)-N-[(2S)-butan-2-yl]-2-ethyl-N'-prop-1-en-2-yl-N-propylbut-2-enimidamide
CID 126516415
N-methyl-1-(5-methyl-2-methylidene-1-pyridinyl)propan-1-imine
CID 130374044
3,5-bis[(1Z)-buta-1,3-dienyl]-N,1,4,6-tetrakis(ethenyl)pyridin-2-imine
CID 134387420
3,6-bis[(1Z)-buta-1,3-dienyl]-N,1,4,5-tetrakis(ethenyl)pyridin-2-imine
CID 134420160
3-[(1Z)-buta-1,3-dienyl]-N,1,5-tris(ethenyl)-4-methyl-6-[(Z)-prop-1-enyl]pyridin-2-imine
CID 134557797
(5Z,6E)-6-ethylidene-N,4-dimethyl-5-(2-nitrosoprop-2-enylidene)-N-propylpyridin-2-amine
CID 138637501
4-ethyl-2,3-dimethyl-6-propan-2-yl-4H-pyrimidine
CID 138714004

Frequently Asked Questions

What is the IUPAC name of (5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine?
The IUPAC name of (5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine (CID 177343084) is (5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine.
What is the SMILES notation for (5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine?
The canonical SMILES for (5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine is C=CC1=NC(=CC)/C(=C\C(=C)C)C(C)N1C.
What is the InChIKey of (5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine?
The InChIKey is BCTMAOIKLTWBTJ-BKHWCZKVSA-N. The full InChI is InChI=1S/C14H20N2/c1-7-13-12(9-10(3)4)11(5)16(6)14(8-2)15-13/h7-9,11H,2-3H2,1,4-6H3/b12-9-,13-7?.
What are the key properties of (5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine?
(5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine has a molecular weight of 216.33 g/mol, XLogP of 3.31, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-2-ethenyl-6-ethylidene-3,4-dimethyl-5-(2-methylprop-2-enylidene)-4H-pyrimidine is sourced from PubChem (CID 177343084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).