2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide

C15H28N2O — CID 113440139

IUPAC2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide
SMILESCN(C(=O)CC1(CN)CCCCC1)C1CCCC1
InChIInChI=1S/C15H28N2O/c1-17(13-7-3-4-8-13)14(18)11-15(12-16)9-5-2-6-10-15/h13H,2-12,16H2,1H3
InChIKeyIDSVHLLYESDMGW-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.69
Rot. Bonds4

About 2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide

2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide (PubChem CID 113440139) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide.

Molecular Properties

Compound Name2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide
PubChem CID113440139
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide
SMILESCN(C(=O)CC1(CN)CCCCC1)C1CCCC1
InChIInChI=1S/C15H28N2O/c1-17(13-7-3-4-8-13)14(18)11-15(12-16)9-5-2-6-10-15/h13H,2-12,16H2,1H3
InChIKeyIDSVHLLYESDMGW-UHFFFAOYSA-N
XLogP2.69
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(aminomethyl)cyclohexyl]-N-methyl-N-(oxan-4-yl)acetamide
CID 104677648
2-[1-(aminomethyl)cyclobutyl]-N-(1-ethylpiperidin-4-yl)-N-methylacetamide
CID 81179607
2-(1-aminocyclopentyl)-N-cyclohexyl-N-methylacetamide
CID 64684539
2-[1-(aminomethyl)cyclohexyl]-N-(1-cyclopropylethyl)-N-methylacetamide
CID 104677614
2-[1-(aminomethyl)cyclobutyl]-N-(2-amino-2-oxoethyl)-N-cyclopentylacetamide
CID 81172433
2-[1-(aminomethyl)cyclohexyl]-N,N-dipropylacetamide
CID 104677371
2-[1-(aminomethyl)cyclohexyl]-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylacetamide
CID 113475600
N-cycloheptyl-2-hydroxy-N-methylacetamide
CID 130678772
2-[1-(aminomethyl)cyclohexyl]-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]acetamide
CID 104678196
2-[1-(aminomethyl)cyclohexyl]-N-methyl-N-(4-methylpentan-2-yl)acetamide
CID 104677794
2-[1-(aminomethyl)cyclohexyl]-N-[2-(diethylamino)-2-oxoethyl]-N-methylacetamide
CID 104677833
2-[1-(aminomethyl)cyclohexyl]-N-(3,3-dimethylbutan-2-yl)-N-methylacetamide
CID 104677793

Frequently Asked Questions

What is the IUPAC name of 2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide?
The IUPAC name of 2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide (CID 113440139) is 2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide.
What is the SMILES notation for 2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide?
The canonical SMILES for 2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide is CN(C(=O)CC1(CN)CCCCC1)C1CCCC1.
What is the InChIKey of 2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide?
The InChIKey is IDSVHLLYESDMGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-17(13-7-3-4-8-13)14(18)11-15(12-16)9-5-2-6-10-15/h13H,2-12,16H2,1H3.
What are the key properties of 2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide?
2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide has a molecular weight of 252.40 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(aminomethyl)cyclohexyl]-N-cyclopentyl-N-methylacetamide is sourced from PubChem (CID 113440139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).