5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide

C19H30N2O — CID 122582438

IUPAC5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide
SMILESCC(C)C1CCC(C)(C)CC1C(=O)NCCc1ccccn1
InChIInChI=1S/C19H30N2O/c1-14(2)16-8-10-19(3,4)13-17(16)18(22)21-12-9-15-7-5-6-11-20-15/h5-7,11,14,16-17H,8-10,12-13H2,1-4H3,(H,21,22)
InChIKeyUSDWTUMNSPEARZ-UHFFFAOYSA-N
MW302.46 g/mol
LogP3.84
Rot. Bonds5

About 5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide

5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide (PubChem CID 122582438) has the molecular formula C19H30N2O and a molecular weight of 302.46 g/mol. Its IUPAC name is 5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide
PubChem CID122582438
Molecular FormulaC19H30N2O
Molecular Weight302.46 g/mol
Exact Mass302.24
IUPAC Name5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide
SMILESCC(C)C1CCC(C)(C)CC1C(=O)NCCc1ccccn1
InChIInChI=1S/C19H30N2O/c1-14(2)16-8-10-19(3,4)13-17(16)18(22)21-12-9-15-7-5-6-11-20-15/h5-7,11,14,16-17H,8-10,12-13H2,1-4H3,(H,21,22)
InChIKeyUSDWTUMNSPEARZ-UHFFFAOYSA-N
XLogP3.84
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.46
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-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

N-ethyl-5,5-dimethyl-2-propan-2-ylcyclohexane-1-carboxamide
CID 122582300
N-(2-pyridin-2-ylethyl)cyclopentanecarboxamide
CID 110872250
ethane;2-methyl-N-(2-pyridin-2-ylethyl)propanamide
CID 142112887
4-hydroxy-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide
CID 112530288
(2R)-2-methylsulfonyl-N-(2-pyridin-2-ylethyl)propanamide
CID 94025060
4-(methylamino)-N-(2-pyridin-2-ylethyl)oxolane-3-carboxamide
CID 66265963
[(1R,5R)-5-methyl-2-propan-2-ylcyclohexyl] N-(2-pyridin-2-ylethyl)carbamate
CID 134351227
N-(2-pyridin-2-ylethyl)oxane-4-carboxamide
CID 51073128
2-chloro-N-(2-pyridin-2-ylethyl)propanamide
CID 24692533
N-[2-(4-methoxyphenyl)-2-oxoethyl]-5,5-dimethyl-2-propan-2-ylcyclohexane-1-carboxamide
CID 135228535
cis-(1R,3S)-3-(2-pyridin-2-ylethylcarbamoyl)cyclopentane-1-carboxylic acid
CID 74235631
2-methyl-3-oxo-3-(2-pyridin-2-ylethylamino)propanoic acid
CID 114897299

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide?
The IUPAC name of 5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide (CID 122582438) is 5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide is CC(C)C1CCC(C)(C)CC1C(=O)NCCc1ccccn1.
What is the InChIKey of 5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide?
The InChIKey is USDWTUMNSPEARZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O/c1-14(2)16-8-10-19(3,4)13-17(16)18(22)21-12-9-15-7-5-6-11-20-15/h5-7,11,14,16-17H,8-10,12-13H2,1-4H3,(H,21,22).
What are the key properties of 5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide?
5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide has a molecular weight of 302.46 g/mol, XLogP of 3.84, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-2-propan-2-yl-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 122582438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).