N-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide

C25H38N4O2 — CID 92621748

IUPACN-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide
SMILESCC1CCN(CCC(=O)N2CCC(c3ccc(C(=O)NC4CCCC4)cn3)CC2)CC1
InChIInChI=1S/C25H38N4O2/c1-19-8-13-28(14-9-19)15-12-24(30)29-16-10-20(11-17-29)23-7-6-21(18-26-23)25(31)27-22-4-2-3-5-22/h6-7,18-20,22H,2-5,8-17H2,1H3,(H,27,31)
InChIKeyTXECNWGFNDSWEB-UHFFFAOYSA-N
MW426.61 g/mol
LogP3.58
Rot. Bonds6

About N-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide

N-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide (PubChem CID 92621748) has the molecular formula C25H38N4O2 and a molecular weight of 426.61 g/mol. Its IUPAC name is N-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide
PubChem CID92621748
Molecular FormulaC25H38N4O2
Molecular Weight426.61 g/mol
Exact Mass426.30
IUPAC NameN-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide
SMILESCC1CCN(CCC(=O)N2CCC(c3ccc(C(=O)NC4CCCC4)cn3)CC2)CC1
InChIInChI=1S/C25H38N4O2/c1-19-8-13-28(14-9-19)15-12-24(30)29-16-10-20(11-17-29)23-7-6-21(18-26-23)25(31)27-22-4-2-3-5-22/h6-7,18-20,22H,2-5,8-17H2,1H3,(H,27,31)
InChIKeyTXECNWGFNDSWEB-UHFFFAOYSA-N
XLogP3.58
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.61
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-6-[1-[2-(methanesulfonamido)acetyl]piperidin-4-yl]pyridine-3-carboxamide
CID 92622486
N-(cyclopropylmethyl)-6-[1-[3-[(3S)-3-methylpiperidin-1-yl]propanoyl]piperidin-4-yl]pyridine-3-carboxamide
CID 95834350
3-[(2R)-2-methylpiperidin-1-yl]-1-[4-[5-(piperidine-1-carbonyl)-2-pyridinyl]piperidin-1-yl]propan-1-one
CID 92621749
N-cyclopentyl-6-[1-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperidin-4-yl]pyridine-3-carboxamide
CID 92621735
N-cyclohexyl-6-(2-piperidin-1-ylethylsulfanyl)pyridine-3-carboxamide
CID 46377949
6-[1-[2-(3-methylpiperidin-1-yl)acetyl]piperidin-4-yl]-N-(1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 110264374
N-cycloheptyl-2-(4-methylpiperidin-1-yl)pyrimidine-5-carboxamide
CID 109250891
6-[1-[3-(4-fluorophenyl)propanoyl]piperidin-4-yl]-N-[[(2S)-oxolan-2-yl]methyl]pyridine-3-carboxamide
CID 92637019
N-cyclohexyl-5-(4-methylpiperidine-1-carbonyl)pyridine-3-carboxamide
CID 109102999
N-cyclopropyl-6-(2-piperidin-1-ylethylsulfanyl)pyridine-3-carboxamide
CID 50820358
N-cyclopentyl-2-(4-methylpiperidine-1-carbonyl)pyridine-4-carboxamide
CID 109080690
N-cyclopentyl-6-[(3S)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]pyridine-3-carboxamide
CID 92636902

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide?
The IUPAC name of N-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide (CID 92621748) is N-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide is CC1CCN(CCC(=O)N2CCC(c3ccc(C(=O)NC4CCCC4)cn3)CC2)CC1.
What is the InChIKey of N-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide?
The InChIKey is TXECNWGFNDSWEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H38N4O2/c1-19-8-13-28(14-9-19)15-12-24(30)29-16-10-20(11-17-29)23-7-6-21(18-26-23)25(31)27-22-4-2-3-5-22/h6-7,18-20,22H,2-5,8-17H2,1H3,(H,27,31).
What are the key properties of N-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide?
N-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide has a molecular weight of 426.61 g/mol, XLogP of 3.58, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-[1-[3-(4-methylpiperidin-1-yl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide is sourced from PubChem (CID 92621748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).