N-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide

C24H38N4O2 — CID 69354661

IUPACN-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide
SMILESCC(C)N1CCC(OC2CCN(c3ccc(C(=O)NC4CCCC4)nc3)CC2)CC1
InChIInChI=1S/C24H38N4O2/c1-18(2)27-13-9-21(10-14-27)30-22-11-15-28(16-12-22)20-7-8-23(25-17-20)24(29)26-19-5-3-4-6-19/h7-8,17-19,21-22H,3-6,9-16H2,1-2H3,(H,26,29)
InChIKeyOOVKDQRQOQCPOO-UHFFFAOYSA-N
MW414.59 g/mol
LogP3.61
Rot. Bonds6

About N-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide

N-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide (PubChem CID 69354661) has the molecular formula C24H38N4O2 and a molecular weight of 414.59 g/mol. Its IUPAC name is N-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide
PubChem CID69354661
Molecular FormulaC24H38N4O2
Molecular Weight414.59 g/mol
Exact Mass414.30
IUPAC NameN-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide
SMILESCC(C)N1CCC(OC2CCN(c3ccc(C(=O)NC4CCCC4)nc3)CC2)CC1
InChIInChI=1S/C24H38N4O2/c1-18(2)27-13-9-21(10-14-27)30-22-11-15-28(16-12-22)20-7-8-23(25-17-20)24(29)26-19-5-3-4-6-19/h7-8,17-19,21-22H,3-6,9-16H2,1-2H3,(H,26,29)
InChIKeyOOVKDQRQOQCPOO-UHFFFAOYSA-N
XLogP3.61
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.59
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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5-[4-[(3-ethyl-2-oxo-1H-1,6-naphthyridin-7-yl)methyl]piperazin-1-yl]-N-methylpyridine-2-carboxamide
CID 155587004
5-[(1S,4S)-5-[(7-ethyl-6-oxo-5H-1,5-naphthyridin-3-yl)methyl]-2,5-diazabicyclo[2.2.1]heptan-2-yl]-N-methylpyridine-2-carboxamide
CID 166065629

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide?
The IUPAC name of N-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide (CID 69354661) is N-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide is CC(C)N1CCC(OC2CCN(c3ccc(C(=O)NC4CCCC4)nc3)CC2)CC1.
What is the InChIKey of N-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide?
The InChIKey is OOVKDQRQOQCPOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H38N4O2/c1-18(2)27-13-9-21(10-14-27)30-22-11-15-28(16-12-22)20-7-8-23(25-17-20)24(29)26-19-5-3-4-6-19/h7-8,17-19,21-22H,3-6,9-16H2,1-2H3,(H,26,29).
What are the key properties of N-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide?
N-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide has a molecular weight of 414.59 g/mol, XLogP of 3.61, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-[4-(1-propan-2-ylpiperidin-4-yl)oxypiperidin-1-yl]pyridine-2-carboxamide is sourced from PubChem (CID 69354661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).