N-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide

C18H27N3O2 — CID 53150978

IUPACN-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide
SMILESO=C(NC1CCCC1)N1CCC(CCOc2ccncc2)CC1
InChIInChI=1S/C18H27N3O2/c22-18(20-16-3-1-2-4-16)21-12-7-15(8-13-21)9-14-23-17-5-10-19-11-6-17/h5-6,10-11,15-16H,1-4,7-9,12-14H2,(H,20,22)
InChIKeyDBGNEMUCCKVZNY-UHFFFAOYSA-N
MW317.43 g/mol
LogP3.21
Rot. Bonds5

About N-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide

N-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide (PubChem CID 53150978) has the molecular formula C18H27N3O2 and a molecular weight of 317.43 g/mol. Its IUPAC name is N-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide
PubChem CID53150978
Molecular FormulaC18H27N3O2
Molecular Weight317.43 g/mol
Exact Mass317.21
IUPAC NameN-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide
SMILESO=C(NC1CCCC1)N1CCC(CCOc2ccncc2)CC1
InChIInChI=1S/C18H27N3O2/c22-18(20-16-3-1-2-4-16)21-12-7-15(8-13-21)9-14-23-17-5-10-19-11-6-17/h5-6,10-11,15-16H,1-4,7-9,12-14H2,(H,20,22)
InChIKeyDBGNEMUCCKVZNY-UHFFFAOYSA-N
XLogP3.21
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S,2R)-2-phenylcyclopropyl]-4-pyridin-4-yloxypiperidine-1-carboxamide
CID 76332320
4-(4-Ethoxy-pyridin-2-ylamino)-piperidine-1-carboxylic acid ethyl ester
CID 11369870
3-[(3R)-4,4-difluorooxolan-3-yl]-1-methyl-1-[(1R)-2-phenoxy-1-pyridin-4-ylethyl]urea
CID 176231322
US11045457, Example 50
CID 146401967
1-[1-(Cyclopentylmethyl)piperidin-4-yl]-3-[(6-methoxy-3-pyridinyl)methyl]urea
CID 51097892
N-(4-Fluorophenyl)-4-[2-(pyridin-4-yloxy)ethyl]piperidine-1-carboxamide
CID 53150966
N-[(4-Fluorophenyl)methyl]-4-[2-(pyridin-4-yloxy)ethyl]piperidine-1-carboxamide
CID 53150982
N-(3-Fluorophenyl)-4-[2-(pyridin-4-yloxy)ethyl]piperidine-1-carboxamide
CID 53150983
N-cyclopentyl-3-pyridin-3-yloxy-1-oxa-8-azaspiro[4.5]decane-8-carboxamide
CID 118741127
N-[4-(4-piperidinomethyl-2-pyridyloxy)-cis-2-butenyl]-N'-isopropylurea
CID 44211251
2-Methyl-1-{4-[2-(4-pyridyloxy)ethyl]piperidino}-1-propanone
CID 53150939
1-{4-[2-(Pyridin-4-yloxy)ethyl]piperidin-1-YL}butan-1-one
CID 53150958

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide?
The IUPAC name of N-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide (CID 53150978) is N-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide?
The canonical SMILES for N-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide is O=C(NC1CCCC1)N1CCC(CCOc2ccncc2)CC1.
What is the InChIKey of N-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide?
The InChIKey is DBGNEMUCCKVZNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O2/c22-18(20-16-3-1-2-4-16)21-12-7-15(8-13-21)9-14-23-17-5-10-19-11-6-17/h5-6,10-11,15-16H,1-4,7-9,12-14H2,(H,20,22).
What are the key properties of N-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide?
N-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide has a molecular weight of 317.43 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-(2-pyridin-4-yloxyethyl)piperidine-1-carboxamide is sourced from PubChem (CID 53150978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).