N-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide

C17H26N2O — CID 60972200

IUPACN-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide
SMILESCC1CCCC(C)C1NCC(=O)NCc1ccccc1
InChIInChI=1S/C17H26N2O/c1-13-7-6-8-14(2)17(13)19-12-16(20)18-11-15-9-4-3-5-10-15/h3-5,9-10,13-14,17,19H,6-8,11-12H2,1-2H3,(H,18,20)
InChIKeyPLASLRXIKKOIBF-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.72
Rot. Bonds5

About N-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide

N-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide (PubChem CID 60972200) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide.

Molecular Properties

Compound NameN-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide
PubChem CID60972200
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide
SMILESCC1CCCC(C)C1NCC(=O)NCc1ccccc1
InChIInChI=1S/C17H26N2O/c1-13-7-6-8-14(2)17(13)19-12-16(20)18-11-15-9-4-3-5-10-15/h3-5,9-10,13-14,17,19H,6-8,11-12H2,1-2H3,(H,18,20)
InChIKeyPLASLRXIKKOIBF-UHFFFAOYSA-N
XLogP2.72
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 43084459
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CID 103601287
N-benzyl-2-(cyclobutylmethylamino)acetamide
CID 43298629
N-benzyl-2-[(2-tert-butylcyclohexyl)amino]acetamide
CID 55868668
N-benzyl-2-[(2,2-dimethylcyclopentyl)amino]acetamide
CID 79859713
N-benzyl-2-[[(1R,2S)-2-ethylsulfanylcyclopentyl]amino]acetamide
CID 124681039
2-[(2,3-dimethylcyclohexyl)amino]-N-[(4-methylphenyl)methyl]acetamide
CID 112770347
trans-(1S,2S)-N-[2-[[2-(benzylamino)-2-oxoethyl]amino]-2-oxoethyl]-2-methylcyclopropane-1-carboxamide
CID 38639487
N-[2-[[2-(benzylamino)-2-oxoethyl]amino]-2-oxoethyl]-2-methylcyclopropane-1-carboxamide
CID 47030850
N-benzyl-2,6-dimethylpiperidine-1-carboxamide
CID 110755036
N-benzyl-2-[(1-ethylazepan-4-yl)amino]acetamide
CID 65073911
N-benzyl-2-[[2-[cyclopropyl(methyl)amino]-2-oxoethyl]amino]acetamide
CID 61488975

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide?
The IUPAC name of N-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide (CID 60972200) is N-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide.
What is the SMILES notation for N-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide?
The canonical SMILES for N-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide is CC1CCCC(C)C1NCC(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide?
The InChIKey is PLASLRXIKKOIBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-13-7-6-8-14(2)17(13)19-12-16(20)18-11-15-9-4-3-5-10-15/h3-5,9-10,13-14,17,19H,6-8,11-12H2,1-2H3,(H,18,20).
What are the key properties of N-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide?
N-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide has a molecular weight of 274.41 g/mol, XLogP of 2.72, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[(2,6-dimethylcyclohexyl)amino]acetamide is sourced from PubChem (CID 60972200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).