N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide

C18H28N2O — CID 164971686

IUPACN-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide
SMILESCC(C)(C)CC1CCC(NC(=O)Cc2ccccn2)CC1
InChIInChI=1S/C18H28N2O/c1-18(2,3)13-14-7-9-15(10-8-14)20-17(21)12-16-6-4-5-11-19-16/h4-6,11,14-15H,7-10,12-13H2,1-3H3,(H,20,21)
InChIKeyUWUZLIIJKSAUGV-UHFFFAOYSA-N
MW288.43 g/mol
LogP3.74
Rot. Bonds4

About N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide

N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide (PubChem CID 164971686) has the molecular formula C18H28N2O and a molecular weight of 288.43 g/mol. Its IUPAC name is N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide.

Molecular Properties

Compound NameN-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide
PubChem CID164971686
Molecular FormulaC18H28N2O
Molecular Weight288.43 g/mol
Exact Mass288.22
IUPAC NameN-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide
SMILESCC(C)(C)CC1CCC(NC(=O)Cc2ccccn2)CC1
InChIInChI=1S/C18H28N2O/c1-18(2,3)13-14-7-9-15(10-8-14)20-17(21)12-16-6-4-5-11-19-16/h4-6,11,14-15H,7-10,12-13H2,1-3H3,(H,20,21)
InChIKeyUWUZLIIJKSAUGV-UHFFFAOYSA-N
XLogP3.74
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[4-(2,2-dimethylpropyl)cyclohexyl]methyl]pyridine
CID 58318500
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-pyridin-2-ylacetamide
CID 61233111
N-cyclopentyl-3-pyridin-2-ylpropanamide
CID 78980134
tert-butyl 4-[[(2-pyridin-2-ylacetyl)amino]methyl]piperidine-1-carboxylate
CID 139805130
N-cycloheptyl-3-pyridin-2-ylpropanamide
CID 110389210
N-[2,2-dimethyl-3-(methylamino)propyl]-2-pyridin-2-ylacetamide
CID 115271190
3-(4-ethylcyclohexyl)-1-methyl-1-(pyridin-2-ylmethyl)urea
CID 86841972
2-(cyclopropylmethylamino)-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide
CID 119901369
tert-butyl N-[4-(2-pyridin-2-ylethylamino)cyclohexyl]carbamate
CID 68885257
N-[4-(2-methylbutan-2-yl)cyclohexyl]-2-(2-pyridin-2-yl-1,3-thiazol-4-yl)acetamide
CID 16563691
N-[(1R,3R)-3-aminocyclopentyl]-2-[methyl(pyridin-2-ylmethyl)amino]acetamide
CID 56868905
4-amino-N-cyclopropyl-3-[methyl(pyridin-2-ylmethyl)amino]butanamide
CID 66431406

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide?
The IUPAC name of N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide (CID 164971686) is N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide.
What is the SMILES notation for N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide?
The canonical SMILES for N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide is CC(C)(C)CC1CCC(NC(=O)Cc2ccccn2)CC1.
What is the InChIKey of N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide?
The InChIKey is UWUZLIIJKSAUGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-18(2,3)13-14-7-9-15(10-8-14)20-17(21)12-16-6-4-5-11-19-16/h4-6,11,14-15H,7-10,12-13H2,1-3H3,(H,20,21).
What are the key properties of N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide?
N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide has a molecular weight of 288.43 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide is sourced from PubChem (CID 164971686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).