N-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide

C16H29N3O — CID 119895220

IUPACN-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide
SMILESO=C(NC1CCN(C2CCCCC2)CC1)C1CCNC1
InChIInChI=1S/C16H29N3O/c20-16(13-6-9-17-12-13)18-14-7-10-19(11-8-14)15-4-2-1-3-5-15/h13-15,17H,1-12H2,(H,18,20)
InChIKeyWDOVSQPOOCRFRJ-UHFFFAOYSA-N
MW279.43 g/mol
LogP1.51
Rot. Bonds3

About N-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide

N-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide (PubChem CID 119895220) has the molecular formula C16H29N3O and a molecular weight of 279.43 g/mol. Its IUPAC name is N-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide
PubChem CID119895220
Molecular FormulaC16H29N3O
Molecular Weight279.43 g/mol
Exact Mass279.23
IUPAC NameN-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide
SMILESO=C(NC1CCN(C2CCCCC2)CC1)C1CCNC1
InChIInChI=1S/C16H29N3O/c20-16(13-6-9-17-12-13)18-14-7-10-19(11-8-14)15-4-2-1-3-5-15/h13-15,17H,1-12H2,(H,18,20)
InChIKeyWDOVSQPOOCRFRJ-UHFFFAOYSA-N
XLogP1.51
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyclohexylpiperidin-4-yl)morpholine-2-carboxamide
CID 119895208
N-(1-cyclopropylpiperidin-4-yl)cyclopentanecarboxamide
CID 110750777
N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)pyrrolidine-3-carboxamide
CID 65470856
N-(1-cyclohexylpyrrolidin-3-yl)cyclohexanecarboxamide
CID 110482205
N-pyrrolidin-3-ylcyclopentanecarboxamide;hydrochloride
CID 146675555
N-cycloheptylpiperidine-4-carboxamide;hydrochloride
CID 70702347
(2R)-N-(1-cyclopentylpiperidin-4-yl)piperidine-2-carboxamide;dihydrochloride
CID 119846635
N-[(3R)-pyrrolidin-3-yl]piperidine-4-carboxamide
CID 91470745
(3S)-N-cyclobutylpiperidine-3-carboxamide
CID 81141296
N-(1-cyclopropylpiperidin-4-yl)-2-methylpiperidine-4-carboxamide
CID 106739107
N-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide
CID 55149500
N-piperidin-4-ylcycloheptanecarboxamide
CID 62587546

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide?
The IUPAC name of N-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide (CID 119895220) is N-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide.
What is the SMILES notation for N-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide?
The canonical SMILES for N-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide is O=C(NC1CCN(C2CCCCC2)CC1)C1CCNC1.
What is the InChIKey of N-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide?
The InChIKey is WDOVSQPOOCRFRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O/c20-16(13-6-9-17-12-13)18-14-7-10-19(11-8-14)15-4-2-1-3-5-15/h13-15,17H,1-12H2,(H,18,20).
What are the key properties of N-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide?
N-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide has a molecular weight of 279.43 g/mol, XLogP of 1.51, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylpiperidin-4-yl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 119895220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).