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

C17H29N3 — CID 64857940

IUPAC1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCCC(CC1CC1)n1c(CC(C)C)nc2c1CCNC2
InChIInChI=1S/C17H29N3/c1-4-14(10-13-5-6-13)20-16-7-8-18-11-15(16)19-17(20)9-12(2)3/h12-14,18H,4-11H2,1-3H3
InChIKeyLYAMKVBCYKQLGX-UHFFFAOYSA-N
MW275.44 g/mol
LogP3.48
Rot. Bonds6

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

1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 64857940) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is 1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID64857940
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC Name1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCCC(CC1CC1)n1c(CC(C)C)nc2c1CCNC2
InChIInChI=1S/C17H29N3/c1-4-14(10-13-5-6-13)20-16-7-8-18-11-15(16)19-17(20)9-12(2)3/h12-14,18H,4-11H2,1-3H3
InChIKeyLYAMKVBCYKQLGX-UHFFFAOYSA-N
XLogP3.48
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 64857940) is 1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is CCC(CC1CC1)n1c(CC(C)C)nc2c1CCNC2.
What is the InChIKey of 1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is LYAMKVBCYKQLGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-4-14(10-13-5-6-13)20-16-7-8-18-11-15(16)19-17(20)9-12(2)3/h12-14,18H,4-11H2,1-3H3.
What are the key properties of 1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 275.44 g/mol, XLogP of 3.48, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 64857940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).