5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine

C8H15N3 — CID 146231366

IUPAC5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine
SMILESC=C1NC2CCN(C)CC2N1
InChIInChI=1S/C8H15N3/c1-6-9-7-3-4-11(2)5-8(7)10-6/h7-10H,1,3-5H2,2H3
InChIKeyLEYSXFFVMVGGKS-UHFFFAOYSA-N
MW153.23 g/mol
LogP-0.28
Rot. Bonds

About 5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine

5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine (PubChem CID 146231366) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine
PubChem CID146231366
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine
SMILESC=C1NC2CCN(C)CC2N1
InChIInChI=1S/C8H15N3/c1-6-9-7-3-4-11(2)5-8(7)10-6/h7-10H,1,3-5H2,2H3
InChIKeyLEYSXFFVMVGGKS-UHFFFAOYSA-N
XLogP-0.28
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine?
The IUPAC name of 5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine (CID 146231366) is 5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine?
The canonical SMILES for 5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine is C=C1NC2CCN(C)CC2N1.
What is the InChIKey of 5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine?
The InChIKey is LEYSXFFVMVGGKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-6-9-7-3-4-11(2)5-8(7)10-6/h7-10H,1,3-5H2,2H3.
What are the key properties of 5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine?
5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine has a molecular weight of 153.23 g/mol, XLogP of -0.28, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-methylidene-3,3a,4,6,7,7a-hexahydro-1H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 146231366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).