[4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone

C24H30N6O — CID 97447633

IUPAC[4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone
SMILESCC(C)n1cnc2c(N3CCCC3)nc(C3CCN(C(=O)c4ccncc4)CC3)cc21
InChIInChI=1S/C24H30N6O/c1-17(2)30-16-26-22-21(30)15-20(27-23(22)28-11-3-4-12-28)18-7-13-29(14-8-18)24(31)19-5-9-25-10-6-19/h5-6,9-10,15-18H,3-4,7-8,11-14H2,1-2H3
InChIKeyADXKVMVKAZZPIK-UHFFFAOYSA-N
MW418.55 g/mol
LogP4.03
Rot. Bonds4

About [4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone

[4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone (PubChem CID 97447633) has the molecular formula C24H30N6O and a molecular weight of 418.55 g/mol. Its IUPAC name is [4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone.

Molecular Properties

Compound Name[4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone
PubChem CID97447633
Molecular FormulaC24H30N6O
Molecular Weight418.55 g/mol
Exact Mass418.25
IUPAC Name[4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone
SMILESCC(C)n1cnc2c(N3CCCC3)nc(C3CCN(C(=O)c4ccncc4)CC3)cc21
InChIInChI=1S/C24H30N6O/c1-17(2)30-16-26-22-21(30)15-20(27-23(22)28-11-3-4-12-28)18-7-13-29(14-8-18)24(31)19-5-9-25-10-6-19/h5-6,9-10,15-18H,3-4,7-8,11-14H2,1-2H3
InChIKeyADXKVMVKAZZPIK-UHFFFAOYSA-N
XLogP4.03
TPSA67.15 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.55
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

[4-[4-[2-methoxyethyl(methyl)amino]-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl]piperidin-1-yl]-pyridin-4-ylmethanone
CID 97447660
furan-3-yl-[4-(1-propan-2-yl-4-pyridin-3-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]methanone
CID 97415351
[4-(1-propan-2-yl-4-pyridin-3-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-3-ylmethanone;bis(2,2,2-trifluoroacetic acid)
CID 155850430
[4-(6-methyl-2-pyridinyl)piperidin-1-yl]-pyridin-4-ylmethanone
CID 95824132
[4-(1-methyl-4-morpholin-4-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-morpholin-4-ylmethanone
CID 97447598
(2,5-difluorophenyl)-[4-(4-phenyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]methanone
CID 97447648
(4-pyrazin-2-ylpiperidin-1-yl)-pyridin-4-ylmethanone
CID 95824131
4-[4-[2-methoxyethyl(methyl)amino]-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl]-N,N-dimethylpiperidine-1-carboxamide
CID 97415376
1-propan-2-yl-4-pyridin-3-yl-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]imidazo[4,5-c]pyridine
CID 97415349
[4-[4-[2-methoxyethyl(methyl)amino]-1-methylimidazo[4,5-c]pyridin-6-yl]piperidin-1-yl]-pyridin-4-ylmethanone;bis(2,2,2-trifluoroacetic acid)
CID 155869233
[4-(1-methyl-4-pyridin-3-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-phenylmethanone;bis(2,2,2-trifluoroacetic acid)
CID 155837911
[3-[6-(1H-imidazol-2-yl)-2-methylpyrimidin-4-yl]pyrrolidin-1-yl]-pyridin-4-ylmethanone
CID 110131923

Frequently Asked Questions

What is the IUPAC name of [4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone?
The IUPAC name of [4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone (CID 97447633) is [4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone.
What is the SMILES notation for [4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone?
The canonical SMILES for [4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone is CC(C)n1cnc2c(N3CCCC3)nc(C3CCN(C(=O)c4ccncc4)CC3)cc21.
What is the InChIKey of [4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone?
The InChIKey is ADXKVMVKAZZPIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N6O/c1-17(2)30-16-26-22-21(30)15-20(27-23(22)28-11-3-4-12-28)18-7-13-29(14-8-18)24(31)19-5-9-25-10-6-19/h5-6,9-10,15-18H,3-4,7-8,11-14H2,1-2H3.
What are the key properties of [4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone?
[4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone has a molecular weight of 418.55 g/mol, XLogP of 4.03, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-propan-2-yl-4-pyrrolidin-1-ylimidazo[4,5-c]pyridin-6-yl)piperidin-1-yl]-pyridin-4-ylmethanone is sourced from PubChem (CID 97447633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).