2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide

C16H24N2O — CID 108993563

IUPAC2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide
SMILESCc1cccc(CNC(=O)CNC2CCCCC2)c1
InChIInChI=1S/C16H24N2O/c1-13-6-5-7-14(10-13)11-18-16(19)12-17-15-8-3-2-4-9-15/h5-7,10,15,17H,2-4,8-9,11-12H2,1H3,(H,18,19)
InChIKeyBFTGDKUTUBSZOP-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.53
Rot. Bonds5

About 2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide

2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide (PubChem CID 108993563) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide
PubChem CID108993563
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide
SMILESCc1cccc(CNC(=O)CNC2CCCCC2)c1
InChIInChI=1S/C16H24N2O/c1-13-6-5-7-14(10-13)11-18-16(19)12-17-15-8-3-2-4-9-15/h5-7,10,15,17H,2-4,8-9,11-12H2,1H3,(H,18,19)
InChIKeyBFTGDKUTUBSZOP-UHFFFAOYSA-N
XLogP2.53
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclohexylamino)-N-[(4-methylphenyl)methyl]acetamide
CID 108993564
N-benzyl-2-(cyclopentylamino)acetamide
CID 43084459
N-[(3-methylphenyl)methyl]cyclopentanamine;oxalic acid
CID 163327213
N-cyclohexyl-2-[(3-methylphenyl)methylamino]acetamide
CID 60903369
2-(cyclopropylamino)-N-[(6-methylnaphthalen-2-yl)methyl]acetamide
CID 115158482
2-(cyclopropylmethylamino)-N-[(3-methylphenyl)methyl]acetamide
CID 60915187
N-cyclohexyl-2-(3-methylphenyl)acetamide
CID 6467373
2-(methylamino)-N-[(3-methylphenyl)methyl]acetamide
CID 60913954
4-N-cycloheptyl-1-N-[(3-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109046875
2-(cyclopropylamino)-N-[(3-ethoxyphenyl)methyl]acetamide
CID 60873169
N-[(3-chlorophenyl)methyl]-2-(cyclopropylamino)acetamide
CID 60647316
2-(cyclopropylamino)-N-[[3-(methoxymethyl)phenyl]methyl]acetamide
CID 54896557

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide?
The IUPAC name of 2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide (CID 108993563) is 2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide is Cc1cccc(CNC(=O)CNC2CCCCC2)c1.
What is the InChIKey of 2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide?
The InChIKey is BFTGDKUTUBSZOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-13-6-5-7-14(10-13)11-18-16(19)12-17-15-8-3-2-4-9-15/h5-7,10,15,17H,2-4,8-9,11-12H2,1H3,(H,18,19).
What are the key properties of 2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide?
2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide has a molecular weight of 260.38 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylamino)-N-[(3-methylphenyl)methyl]acetamide is sourced from PubChem (CID 108993563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).