1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide

C18H32N2O3 — CID 111445850

IUPAC1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide
SMILESCC(C)(C)C(=O)N1CCC(C(=O)NCC2(O)CCCCC2)CC1
InChIInChI=1S/C18H32N2O3/c1-17(2,3)16(22)20-11-7-14(8-12-20)15(21)19-13-18(23)9-5-4-6-10-18/h14,23H,4-13H2,1-3H3,(H,19,21)
InChIKeyUMQJVIOYLSXZAT-UHFFFAOYSA-N
MW324.47 g/mol
LogP2.08
Rot. Bonds3

About 1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide

1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide (PubChem CID 111445850) has the molecular formula C18H32N2O3 and a molecular weight of 324.47 g/mol. Its IUPAC name is 1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide
PubChem CID111445850
Molecular FormulaC18H32N2O3
Molecular Weight324.47 g/mol
Exact Mass324.24
IUPAC Name1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide
SMILESCC(C)(C)C(=O)N1CCC(C(=O)NCC2(O)CCCCC2)CC1
InChIInChI=1S/C18H32N2O3/c1-17(2,3)16(22)20-11-7-14(8-12-20)15(21)19-13-18(23)9-5-4-6-10-18/h14,23H,4-13H2,1-3H3,(H,19,21)
InChIKeyUMQJVIOYLSXZAT-UHFFFAOYSA-N
XLogP2.08
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.47
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl N-[1-[[[1-(2,2-dimethylpropanoyl)piperidine-4-carbonyl]amino]methyl]cycloheptyl]carbamate
CID 31863595
N-[(1-hydroxycyclohexyl)methyl]cycloheptanecarboxamide
CID 65114198
N-[(1-hydroxycyclopentyl)methyl]-4-methylcyclohexane-1-carboxamide
CID 79005811
1-(furan-3-carbonyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide
CID 111445987
N-[[1-(hydroxymethyl)cyclopentyl]methyl]-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide
CID 110416791
N-[(1-hydroxycycloheptyl)methyl]-1-pyrimidin-2-ylpiperidine-4-carboxamide
CID 111428735
1-tert-butyl-N-[(1-hydroxycyclohexyl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 131914241
1-(2,2-dimethylpropanoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]piperidine-3-carboxamide
CID 47987115
ethyl 4-[[1-(2,2-dimethylpropanoyl)piperidine-4-carbonyl]amino]butanoate
CID 78794482
1-[2-(1-hydroxycyclohexyl)acetyl]-N-pentylpiperidine-4-carboxamide
CID 111536677
N-[(1-hydroxy-4-methylcyclohexyl)methyl]cyclopropanecarboxamide
CID 65119591
1-(2,2-dimethylpropanoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]piperidine-3-carboxamide;hydrochloride
CID 120888136

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide?
The IUPAC name of 1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide (CID 111445850) is 1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide is CC(C)(C)C(=O)N1CCC(C(=O)NCC2(O)CCCCC2)CC1.
What is the InChIKey of 1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide?
The InChIKey is UMQJVIOYLSXZAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O3/c1-17(2,3)16(22)20-11-7-14(8-12-20)15(21)19-13-18(23)9-5-4-6-10-18/h14,23H,4-13H2,1-3H3,(H,19,21).
What are the key properties of 1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide?
1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide has a molecular weight of 324.47 g/mol, XLogP of 2.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylpropanoyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 111445850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).