4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone

C15H24N4O — CID 114593081

IUPAC4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone
SMILESCC1CC(C)C(C)N(C(=O)C2Cc3nc[nH]c3CN2)C1
InChIInChI=1S/C15H24N4O/c1-9-4-10(2)11(3)19(7-9)15(20)13-5-12-14(6-16-13)18-8-17-12/h8-11,13,16H,4-7H2,1-3H3,(H,17,18)
InChIKeyCSRMCYIDEJQQFC-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.32
Rot. Bonds1

About 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone

4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone (PubChem CID 114593081) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone
PubChem CID114593081
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone
SMILESCC1CC(C)C(C)N(C(=O)C2Cc3nc[nH]c3CN2)C1
InChIInChI=1S/C15H24N4O/c1-9-4-10(2)11(3)19(7-9)15(20)13-5-12-14(6-16-13)18-8-17-12/h8-11,13,16H,4-7H2,1-3H3,(H,17,18)
InChIKeyCSRMCYIDEJQQFC-UHFFFAOYSA-N
XLogP1.32
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone?
The IUPAC name of 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone (CID 114593081) is 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone.
What is the SMILES notation for 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone?
The canonical SMILES for 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone is CC1CC(C)C(C)N(C(=O)C2Cc3nc[nH]c3CN2)C1.
What is the InChIKey of 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone?
The InChIKey is CSRMCYIDEJQQFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-9-4-10(2)11(3)19(7-9)15(20)13-5-12-14(6-16-13)18-8-17-12/h8-11,13,16H,4-7H2,1-3H3,(H,17,18).
What are the key properties of 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone?
4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone has a molecular weight of 276.38 g/mol, XLogP of 1.32, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridin-6-yl-(2,3,5-trimethylpiperidin-1-yl)methanone is sourced from PubChem (CID 114593081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).