(5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine

C10H12N2 — CID 145321676

IUPAC(5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine
SMILESC=C/C=c1/c(C)nc(C)nc1=C
InChIInChI=1S/C10H12N2/c1-5-6-10-7(2)11-9(4)12-8(10)3/h5-6H,1-2H2,3-4H3/b10-6+
InChIKeyDTCREBTVGPKEFD-UXBLZVDNSA-N
MW160.22 g/mol
LogP0.47
Rot. Bonds1

About (5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine

(5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine (PubChem CID 145321676) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is (5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine.

Molecular Properties

Compound Name(5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine
PubChem CID145321676
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name(5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine
SMILESC=C/C=c1/c(C)nc(C)nc1=C
InChIInChI=1S/C10H12N2/c1-5-6-10-7(2)11-9(4)12-8(10)3/h5-6H,1-2H2,3-4H3/b10-6+
InChIKeyDTCREBTVGPKEFD-UXBLZVDNSA-N
XLogP0.47
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 50.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-4H-benzimidazole
CID 12998085
2,4-dimethyl-5H-pyrimido[4,5-b]indole
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8,10-Diazatetracyclo[7.7.0.02,7.011,15]hexadeca-1,3,5,7,9,11,13,15-octaene
CID 21887617
1H-indolo[2,3-b]quinoxaline
CID 21888108
4,6-dimethyl-2-[(E)-pent-2-en-3-yl]-5H-pyrimidin-5-ide;yttrium
CID 58291705
7,8-Dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine
CID 58462768
4-methyl-8H-quinazolin-8-ide;yttrium
CID 58945777
4-methyl-5H-quinazolin-5-ide;yttrium
CID 58945779
4-Methyl-6,7-dihydroquinazoline
CID 59065946
4,6-dimethyl-2H-quinazolin-2-ide;yttrium
CID 60007882
2-Methylpyrrolo[2,3-b]indole
CID 67634624
2-Methyl-3,6-dimethylidenepyridine
CID 70499080

Frequently Asked Questions

What is the IUPAC name of (5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine?
The IUPAC name of (5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine (CID 145321676) is (5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine.
What is the SMILES notation for (5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine?
The canonical SMILES for (5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine is C=C/C=c1/c(C)nc(C)nc1=C.
What is the InChIKey of (5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine?
The InChIKey is DTCREBTVGPKEFD-UXBLZVDNSA-N. The full InChI is InChI=1S/C10H12N2/c1-5-6-10-7(2)11-9(4)12-8(10)3/h5-6H,1-2H2,3-4H3/b10-6+.
What are the key properties of (5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine?
(5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine has a molecular weight of 160.22 g/mol, XLogP of 0.47, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5E)-2,4-dimethyl-6-methylidene-5-prop-2-enylidenepyrimidine is sourced from PubChem (CID 145321676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).