N-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide

C18H32N2O — CID 16895616

IUPACN-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide
SMILESO=C(NCC1CCN(C2CCCC2)CC1)C1CCCCC1
InChIInChI=1S/C18H32N2O/c21-18(16-6-2-1-3-7-16)19-14-15-10-12-20(13-11-15)17-8-4-5-9-17/h15-17H,1-14H2,(H,19,21)
InChIKeyHVOFJFRJTYNORY-UHFFFAOYSA-N
MW292.47 g/mol
LogP3.34
Rot. Bonds4

About N-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide

N-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide (PubChem CID 16895616) has the molecular formula C18H32N2O and a molecular weight of 292.47 g/mol. Its IUPAC name is N-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide
PubChem CID16895616
Molecular FormulaC18H32N2O
Molecular Weight292.47 g/mol
Exact Mass292.25
IUPAC NameN-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide
SMILESO=C(NCC1CCN(C2CCCC2)CC1)C1CCCCC1
InChIInChI=1S/C18H32N2O/c21-18(16-6-2-1-3-7-16)19-14-15-10-12-20(13-11-15)17-8-4-5-9-17/h15-17H,1-14H2,(H,19,21)
InChIKeyHVOFJFRJTYNORY-UHFFFAOYSA-N
XLogP3.34
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Cyclopentyl-1-(piperazin-1-yl)propan-1-one
CID 767567
(2S)-2-amino-2-cyclohexyl-1-(piperidin-1-yl)ethan-1-one
CID 23646030
N-(2,2,6,6-tetramethylpiperidin-4-yl)cyclohexanecarboxamide
CID 845135
N-(piperidin-4-yl)cyclohexanecarboxamide
CID 1445167
N-cyclohexyl-3-cyclopentylpropanamide
CID 835664
Cyclohexanecarboxylic acid (9-butyl-9-aza-bicyclo[3.3.1]non-3-yl)-amide
CID 3218215
2-cyclohexyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)acetamide
CID 651966
2-Cyclohexylamino-1-piperidin-1-yl-propan-1-one
CID 10376940
2-Amino-2-cyclohexyl-1-piperidin-1-yl-ethanone
CID 44364133
N-cyclohexylcyclohexanecarboxamide
CID 344739
Pentanamide, N-(1-(1-oxo-2-propylpentyl)-4-piperidinyl)-2-propyl-
CID 3075854
Cyclohexanecarboxylic acid (9-propyl-9-aza-bicyclo[3.3.1]non-3-yl)-amide
CID 3217977

Frequently Asked Questions

What is the IUPAC name of N-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide?
The IUPAC name of N-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide (CID 16895616) is N-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide?
The canonical SMILES for N-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide is O=C(NCC1CCN(C2CCCC2)CC1)C1CCCCC1.
What is the InChIKey of N-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide?
The InChIKey is HVOFJFRJTYNORY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O/c21-18(16-6-2-1-3-7-16)19-14-15-10-12-20(13-11-15)17-8-4-5-9-17/h15-17H,1-14H2,(H,19,21).
What are the key properties of N-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide?
N-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide has a molecular weight of 292.47 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-cyclopentylpiperidin-4-yl)methyl]cyclohexanecarboxamide is sourced from PubChem (CID 16895616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).