1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

C16H29N3 — CID 64857950

IUPAC1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCC(C)CCCn1c(CC(C)C)nc2c1CCNC2
InChIInChI=1S/C16H29N3/c1-12(2)6-5-9-19-15-7-8-17-11-14(15)18-16(19)10-13(3)4/h12-13,17H,5-11H2,1-4H3
InChIKeyJNXMWTDZIHJICN-UHFFFAOYSA-N
MW263.43 g/mol
LogP3.16
Rot. Bonds6

About 1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 64857950) has the molecular formula C16H29N3 and a molecular weight of 263.43 g/mol. Its IUPAC name is 1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID64857950
Molecular FormulaC16H29N3
Molecular Weight263.43 g/mol
Exact Mass263.24
IUPAC Name1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCC(C)CCCn1c(CC(C)C)nc2c1CCNC2
InChIInChI=1S/C16H29N3/c1-12(2)6-5-9-19-15-7-8-17-11-14(15)18-16(19)10-13(3)4/h12-13,17H,5-11H2,1-4H3
InChIKeyJNXMWTDZIHJICN-UHFFFAOYSA-N
XLogP3.16
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 64857950) is 1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is CC(C)CCCn1c(CC(C)C)nc2c1CCNC2.
What is the InChIKey of 1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is JNXMWTDZIHJICN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3/c1-12(2)6-5-9-19-15-7-8-17-11-14(15)18-16(19)10-13(3)4/h12-13,17H,5-11H2,1-4H3.
What are the key properties of 1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 263.43 g/mol, XLogP of 3.16, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 64857950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).