N-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide

C18H32N2O — CID 45199037

IUPACN-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide
SMILESO=C(NC1CCCN(C2CCCCCC2)C1)C1CCCC1
InChIInChI=1S/C18H32N2O/c21-18(15-8-5-6-9-15)19-16-10-7-13-20(14-16)17-11-3-1-2-4-12-17/h15-17H,1-14H2,(H,19,21)
InChIKeyOMIRVPCGKWZQTC-UHFFFAOYSA-N
MW292.47 g/mol
LogP3.48
Rot. Bonds3

About N-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide

N-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide (PubChem CID 45199037) has the molecular formula C18H32N2O and a molecular weight of 292.47 g/mol. Its IUPAC name is N-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide
PubChem CID45199037
Molecular FormulaC18H32N2O
Molecular Weight292.47 g/mol
Exact Mass292.25
IUPAC NameN-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide
SMILESO=C(NC1CCCN(C2CCCCCC2)C1)C1CCCC1
InChIInChI=1S/C18H32N2O/c21-18(15-8-5-6-9-15)19-16-10-7-13-20(14-16)17-11-3-1-2-4-12-17/h15-17H,1-14H2,(H,19,21)
InChIKeyOMIRVPCGKWZQTC-UHFFFAOYSA-N
XLogP3.48
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyclohexylpyrrolidin-3-yl)cyclohexanecarboxamide
CID 110482205
N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]cycloheptanecarboxamide
CID 45184033
N-[1-(1-methylpiperidin-4-yl)piperidin-3-yl]cyclopentanecarboxamide
CID 45181380
ethyl 4-[(3R)-3-(cyclohexanecarbonylamino)piperidin-1-yl]piperidine-1-carboxylate
CID 46872062
ethyl 4-[3-(cyclopentanecarbonylamino)piperidin-1-yl]piperidine-1-carboxylate
CID 75239371
N-cycloheptylcycloheptanecarboxamide
CID 129091005
N-cyclodecylcyclododecanecarboxamide
CID 135182352
(1-cyclopropylpiperidin-3-yl)carbamic acid
CID 170157266
N-(1-cyclopropylpiperidin-4-yl)cyclopentanecarboxamide
CID 110750777
1-[1-(cyclopentanecarbonyl)piperidin-4-yl]-N-cyclopropylpiperidine-3-carboxamide
CID 45224052
1-[(3R)-1-cycloheptylpiperidin-3-yl]-3-ethylurea
CID 42383897
N-[(3R)-1-cycloheptylpiperidin-3-yl]-2-methylsulfanylacetamide
CID 42567206

Frequently Asked Questions

What is the IUPAC name of N-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide?
The IUPAC name of N-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide (CID 45199037) is N-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide.
What is the SMILES notation for N-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide?
The canonical SMILES for N-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide is O=C(NC1CCCN(C2CCCCCC2)C1)C1CCCC1.
What is the InChIKey of N-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide?
The InChIKey is OMIRVPCGKWZQTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O/c21-18(15-8-5-6-9-15)19-16-10-7-13-20(14-16)17-11-3-1-2-4-12-17/h15-17H,1-14H2,(H,19,21).
What are the key properties of N-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide?
N-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide has a molecular weight of 292.47 g/mol, XLogP of 3.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide is sourced from PubChem (CID 45199037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).