N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide

C16H30N2O — CID 175621352

IUPACN-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide
SMILESCCC(=O)NC1CCN(CC2CCC(C)CC2)CC1
InChIInChI=1S/C16H30N2O/c1-3-16(19)17-15-8-10-18(11-9-15)12-14-6-4-13(2)5-7-14/h13-15H,3-12H2,1-2H3,(H,17,19)
InChIKeyQIRRIHMLRCMNGT-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.80
Rot. Bonds4

About N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide

N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide (PubChem CID 175621352) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide
PubChem CID175621352
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide
SMILESCCC(=O)NC1CCN(CC2CCC(C)CC2)CC1
InChIInChI=1S/C16H30N2O/c1-3-16(19)17-15-8-10-18(11-9-15)12-14-6-4-13(2)5-7-14/h13-15H,3-12H2,1-2H3,(H,17,19)
InChIKeyQIRRIHMLRCMNGT-UHFFFAOYSA-N
XLogP2.80
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide 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

1-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propan-1-one
CID 167284458
N-[1-(2-methylpropyl)piperidin-4-yl]propanamide
CID 71193586
N-[1-(cyclopropylmethyl)piperidin-4-yl]-2-(2-methoxyethylamino)acetamide;dihydrochloride
CID 119854245
2-(cyclopropylmethylamino)-N-(1-ethylpiperidin-4-yl)acetamide
CID 54917428
1-(cyclopropylmethyl)-4-methylpiperidine
CID 54039585
N-[1-(cyclopentylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide
CID 60600680
N-[1-(cyclohexylmethyl)piperidin-4-yl]-3-methylpiperidine-1-carboxamide
CID 60601133
ethane;methane;4-methyl-1-[(4-methylcyclohexyl)methyl]piperidine
CID 167474854
ethane;N-[4-(propanoylamino)cyclohexyl]propanamide
CID 144871719
tert-butyl N-[1-(cyclopropylmethyl)piperidin-4-yl]carbamate
CID 53255882
N-(4-methylcyclohexyl)-2-(propylamino)acetamide
CID 60671942
1-[(4-ethylcyclohexyl)methyl]-4-methylpiperidine
CID 167550394

Frequently Asked Questions

What is the IUPAC name of N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide?
The IUPAC name of N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide (CID 175621352) is N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide.
What is the SMILES notation for N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide?
The canonical SMILES for N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide is CCC(=O)NC1CCN(CC2CCC(C)CC2)CC1.
What is the InChIKey of N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide?
The InChIKey is QIRRIHMLRCMNGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-3-16(19)17-15-8-10-18(11-9-15)12-14-6-4-13(2)5-7-14/h13-15H,3-12H2,1-2H3,(H,17,19).
What are the key properties of N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide?
N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide has a molecular weight of 266.43 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[(4-methylcyclohexyl)methyl]piperidin-4-yl]propanamide is sourced from PubChem (CID 175621352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).