(7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine

C12H18N2 — CID 163390217

IUPAC(7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine
SMILESCc1cn2c(n1)C/C(=C/C(C)C)CC2
InChIInChI=1S/C12H18N2/c1-9(2)6-11-4-5-14-8-10(3)13-12(14)7-11/h6,8-9H,4-5,7H2,1-3H3/b11-6+
InChIKeyPYLWXCJFVAIMMG-IZZDOVSWSA-N
MW190.29 g/mol
LogP2.72
Rot. Bonds1

About (7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine

(7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine (PubChem CID 163390217) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is (7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name(7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine
PubChem CID163390217
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name(7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine
SMILESCc1cn2c(n1)C/C(=C/C(C)C)CC2
InChIInChI=1S/C12H18N2/c1-9(2)6-11-4-5-14-8-10(3)13-12(14)7-11/h6,8-9H,4-5,7H2,1-3H3/b11-6+
InChIKeyPYLWXCJFVAIMMG-IZZDOVSWSA-N
XLogP2.72
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine?
The IUPAC name of (7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine (CID 163390217) is (7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine.
What is the SMILES notation for (7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine?
The canonical SMILES for (7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine is Cc1cn2c(n1)C/C(=C/C(C)C)CC2.
What is the InChIKey of (7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine?
The InChIKey is PYLWXCJFVAIMMG-IZZDOVSWSA-N. The full InChI is InChI=1S/C12H18N2/c1-9(2)6-11-4-5-14-8-10(3)13-12(14)7-11/h6,8-9H,4-5,7H2,1-3H3/b11-6+.
What are the key properties of (7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine?
(7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine has a molecular weight of 190.29 g/mol, XLogP of 2.72, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7E)-2-methyl-7-(2-methylpropylidene)-6,8-dihydro-5H-imidazo[1,2-a]pyridine is sourced from PubChem (CID 163390217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).