(2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine

C12H16N2 — CID 143342976

IUPAC(2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine
SMILESC=CC1=N/C(=C/C)N(C)C(C(=C)C)=C1
InChIInChI=1S/C12H16N2/c1-6-10-8-11(9(3)4)14(5)12(7-2)13-10/h6-8H,1,3H2,2,4-5H3/b12-7-
InChIKeyKHKOJCKNWWREIX-GHXNOFRVSA-N
MW188.27 g/mol
LogP2.88
Rot. Bonds2

About (2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine

(2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine (PubChem CID 143342976) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is (2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine.

Molecular Properties

Compound Name(2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine
PubChem CID143342976
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Name(2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine
SMILESC=CC1=N/C(=C/C)N(C)C(C(=C)C)=C1
InChIInChI=1S/C12H16N2/c1-6-10-8-11(9(3)4)14(5)12(7-2)13-10/h6-8H,1,3H2,2,4-5H3/b12-7-
InChIKeyKHKOJCKNWWREIX-GHXNOFRVSA-N
XLogP2.88
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N,N',N'-tetramethyl-1-[3-(propan-2-ylideneamino)cyclopenta-2,4-dien-1-ylidene]methanediamine
CID 134987383
3,14-Dimethyl-3,14,21,24-tetrazahexacyclo[14.2.2.12,5.14,8.19,13.112,15]tetracosa-1,4(23),5(24),6,8,10,12(21),13(22),15,17,19-undecaene
CID 20233383
(2E,4E)-N,N-dimethyl-3-[(6-methylidenecyclohexa-2,4-dien-1-ylidene)amino]hexa-2,4-dien-2-amine
CID 89441651
(E)-N,N,3-trimethyl-4-[(2Z)-4-methylpenta-2,4-dien-2-yl]imino-2-[(Z)-prop-1-enyl]pent-2-en-1-amine
CID 126636351
1-[3,4-bis(methylimino)cyclohexa-1,5-dien-1-yl]-N,N-dimethylethenamine
CID 132039809
(2E)-6-but-1-en-2-yl-4-ethenyl-1-methyl-2-prop-2-enylidenepyrimidine;methanamine
CID 143343106
[(2E)-6-but-1-en-2-yl-1-methyl-2-(2-methylprop-2-enylidene)pyrimidin-4-yl]methylidenephosphane
CID 143343608
Acetylene;6-but-1-en-2-yl-4-ethenyl-1-methyl-2-methylidenepyrimidine;ethane
CID 143345365
2-[(E)-(6-but-1-en-2-yl-4-ethenyl-1-methylpyrimidin-2-ylidene)methyl]prop-2-enenitrile
CID 143346692
(2E)-1,4,6-trimethyl-2-prop-2-enylidenepyrimidine
CID 143477369
5-[(1Z)-buta-1,3-dienyl]-6-ethenyl-1-propyl-2H-pyrimidine
CID 144168442
1,2-Dimethyl-6,7-dihydroquinolin-1-ium;ethane
CID 144659210

Frequently Asked Questions

What is the IUPAC name of (2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine?
The IUPAC name of (2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine (CID 143342976) is (2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine.
What is the SMILES notation for (2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine?
The canonical SMILES for (2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine is C=CC1=N/C(=C/C)N(C)C(C(=C)C)=C1.
What is the InChIKey of (2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine?
The InChIKey is KHKOJCKNWWREIX-GHXNOFRVSA-N. The full InChI is InChI=1S/C12H16N2/c1-6-10-8-11(9(3)4)14(5)12(7-2)13-10/h6-8H,1,3H2,2,4-5H3/b12-7-.
What are the key properties of (2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine?
(2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine has a molecular weight of 188.27 g/mol, XLogP of 2.88, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-4-ethenyl-2-ethylidene-1-methyl-6-prop-1-en-2-ylpyrimidine is sourced from PubChem (CID 143342976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).