2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide

C22H34N2O — CID 14208397

IUPAC2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide
SMILESCN(C(=O)CNC1CCCCC1)C(c1ccccc1)C1CCCCC1
InChIInChI=1S/C22H34N2O/c1-24(21(25)17-23-20-15-9-4-10-16-20)22(18-11-5-2-6-12-18)19-13-7-3-8-14-19/h2,5-6,11-12,19-20,22-23H,3-4,7-10,13-17H2,1H3
InChIKeyJBXRMTWBELDQPN-UHFFFAOYSA-N
MW342.53 g/mol
LogP4.69
Rot. Bonds6

About 2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide

2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide (PubChem CID 14208397) has the molecular formula C22H34N2O and a molecular weight of 342.53 g/mol. Its IUPAC name is 2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide.

Molecular Properties

Compound Name2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide
PubChem CID14208397
Molecular FormulaC22H34N2O
Molecular Weight342.53 g/mol
Exact Mass342.27
IUPAC Name2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide
SMILESCN(C(=O)CNC1CCCCC1)C(c1ccccc1)C1CCCCC1
InChIInChI=1S/C22H34N2O/c1-24(21(25)17-23-20-15-9-4-10-16-20)22(18-11-5-2-6-12-18)19-13-7-3-8-14-19/h2,5-6,11-12,19-20,22-23H,3-4,7-10,13-17H2,1H3
InChIKeyJBXRMTWBELDQPN-UHFFFAOYSA-N
XLogP4.69
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.53
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[2-(cyclopentylamino)acetyl]-methylamino]propanoic acid
CID 62637271
N-[cyclopentyl(phenyl)methyl]-2-imidazol-1-yl-N-methylacetamide
CID 166627921
2-(cyclohexylamino)-N-(1-phenylpropyl)acetamide
CID 54816670
2-(cyclododecylamino)-N,N-dimethylacetamide
CID 43214559
N-(2-anilino-2-oxoethyl)-2-(cyclopentylamino)-N-methylacetamide
CID 60944498
N-benzyl-2-(cyclopentylamino)-N-cyclopropylacetamide
CID 60846421
2-(cyclooctylamino)acetic acid;2-(cyclopropylamino)acetic acid;2-(cycloundecylamino)acetic acid;2-(2,2-diphenylethylamino)acetic acid
CID 160746773
2-(cyclopentylamino)-N-(2-hydroxy-1-phenylethyl)acetamide
CID 63184083
N-[(2-bromophenyl)methyl]-2-(cyclopentylamino)-N-methylacetamide
CID 60647343
2-(cyclooctylamino)-N-ethyl-N-methylacetamide
CID 43309596
[1-(cyclohexylamino)-2-methylpropan-2-yl] 2,2-diphenylacetate;hydrochloride
CID 24843488
4-[cyclohexyl(dimethylamino)methyl]benzoic acid
CID 116908454

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide?
The IUPAC name of 2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide (CID 14208397) is 2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide.
What is the SMILES notation for 2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide?
The canonical SMILES for 2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide is CN(C(=O)CNC1CCCCC1)C(c1ccccc1)C1CCCCC1.
What is the InChIKey of 2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide?
The InChIKey is JBXRMTWBELDQPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N2O/c1-24(21(25)17-23-20-15-9-4-10-16-20)22(18-11-5-2-6-12-18)19-13-7-3-8-14-19/h2,5-6,11-12,19-20,22-23H,3-4,7-10,13-17H2,1H3.
What are the key properties of 2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide?
2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide has a molecular weight of 342.53 g/mol, XLogP of 4.69, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylamino)-N-[cyclohexyl(phenyl)methyl]-N-methylacetamide is sourced from PubChem (CID 14208397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).