N-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide

C20H28N4O2 — CID 50842519

IUPACN-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide
SMILESO=C(Nc1ccc(N2CCCC(C(=O)NC3CCCC3)C2)nc1)C1CC1
InChIInChI=1S/C20H28N4O2/c25-19(14-7-8-14)23-17-9-10-18(21-12-17)24-11-3-4-15(13-24)20(26)22-16-5-1-2-6-16/h9-10,12,14-16H,1-8,11,13H2,(H,22,26)(H,23,25)
InChIKeyBTVUIQDLHWURFG-UHFFFAOYSA-N
MW356.47 g/mol
LogP2.71
Rot. Bonds5

About N-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide

N-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide (PubChem CID 50842519) has the molecular formula C20H28N4O2 and a molecular weight of 356.47 g/mol. Its IUPAC name is N-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide
PubChem CID50842519
Molecular FormulaC20H28N4O2
Molecular Weight356.47 g/mol
Exact Mass356.22
IUPAC NameN-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide
SMILESO=C(Nc1ccc(N2CCCC(C(=O)NC3CCCC3)C2)nc1)C1CC1
InChIInChI=1S/C20H28N4O2/c25-19(14-7-8-14)23-17-9-10-18(21-12-17)24-11-3-4-15(13-24)20(26)22-16-5-1-2-6-16/h9-10,12,14-16H,1-8,11,13H2,(H,22,26)(H,23,25)
InChIKeyBTVUIQDLHWURFG-UHFFFAOYSA-N
XLogP2.71
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]cyclobutanecarboxamide
CID 113015663
1-(5-fluoro-2-pyridinyl)-N-(oxan-4-yl)piperidine-3-carboxamide
CID 165431316
1-[5-[(1-methylsulfonylpiperidine-4-carbonyl)amino]-2-pyridinyl]piperidine-3-carboxamide
CID 55700725
N-[6-(3-methylpiperidin-1-yl)-3-pyridinyl]oxane-4-carboxamide
CID 113015664
1-N-cyclopentyl-4-N-(4-piperidin-1-ylphenyl)cyclohexane-1,4-dicarboxamide
CID 109145891
N-(6-piperidin-1-yl-3-pyridinyl)oxane-4-carboxamide
CID 30179936
1-[5-(butanoylamino)-2-pyridinyl]-N-cyclopentylpiperidine-4-carboxamide
CID 50842589
N-cyclopropyl-1-quinoxalin-2-ylpiperidine-3-carboxamide
CID 49431443
N-cyclohexyl-1-[5-(3-methylbutanoylamino)-2-pyridinyl]piperidine-4-carboxamide
CID 50842318
(3S)-N-(4-bromophenyl)-1-(5-nitro-2-pyridinyl)piperidine-3-carboxamide
CID 29105857
(3S)-1-(5-cyano-2-pyridinyl)-N-phenylpiperidine-3-carboxamide
CID 51928820
1-(3,5-dimethylbenzoyl)-N-(6-piperidin-1-yl-3-pyridinyl)piperidine-3-carboxamide
CID 138996186

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide?
The IUPAC name of N-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide (CID 50842519) is N-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide is O=C(Nc1ccc(N2CCCC(C(=O)NC3CCCC3)C2)nc1)C1CC1.
What is the InChIKey of N-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide?
The InChIKey is BTVUIQDLHWURFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O2/c25-19(14-7-8-14)23-17-9-10-18(21-12-17)24-11-3-4-15(13-24)20(26)22-16-5-1-2-6-16/h9-10,12,14-16H,1-8,11,13H2,(H,22,26)(H,23,25).
What are the key properties of N-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide?
N-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide has a molecular weight of 356.47 g/mol, XLogP of 2.71, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-[5-(cyclopropanecarbonylamino)-2-pyridinyl]piperidine-3-carboxamide is sourced from PubChem (CID 50842519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).