N-[2-[(cyclohexylamino)methyl]phenyl]acetamide

C15H22N2O — CID 66289861

IUPACN-[2-[(cyclohexylamino)methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1CNC1CCCCC1
InChIInChI=1S/C15H22N2O/c1-12(18)17-15-10-6-5-7-13(15)11-16-14-8-3-2-4-9-14/h5-7,10,14,16H,2-4,8-9,11H2,1H3,(H,17,18)
InChIKeyDUEMHMOSIOXPOV-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.07
Rot. Bonds4

About N-[2-[(cyclohexylamino)methyl]phenyl]acetamide

N-[2-[(cyclohexylamino)methyl]phenyl]acetamide (PubChem CID 66289861) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-[2-[(cyclohexylamino)methyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[(cyclohexylamino)methyl]phenyl]acetamide
PubChem CID66289861
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-[2-[(cyclohexylamino)methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1CNC1CCCCC1
InChIInChI=1S/C15H22N2O/c1-12(18)17-15-10-6-5-7-13(15)11-16-14-8-3-2-4-9-14/h5-7,10,14,16H,2-4,8-9,11H2,1H3,(H,17,18)
InChIKeyDUEMHMOSIOXPOV-UHFFFAOYSA-N
XLogP3.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[[(1-ethylpiperidin-3-yl)amino]methyl]phenyl]acetamide
CID 66419821
N-[2-[[(3-methoxycyclobutyl)amino]methyl]phenyl]acetamide
CID 113429848
N-[2-[[[(1R)-1-cyclopentylethyl]amino]methyl]phenyl]acetamide
CID 81394935
N-[2-[(1-cyclohexylpropylamino)methyl]phenyl]acetamide
CID 66419635
N-[2-[[(2,2-dimethyloxan-4-yl)amino]methyl]phenyl]acetamide
CID 115563696
N-[2-(cyclohexylcarbamoylamino)phenyl]acetamide
CID 113093681
N-[2-[[(5-oxopyrrolidin-3-yl)amino]methyl]phenyl]acetamide
CID 114155218
methyl 2-[2-[(cycloheptylamino)methyl]phenyl]acetate
CID 115461578
2-[(cyclohexylamino)methyl]benzoic acid
CID 17156908
2-[(cyclohexylamino)methyl]benzoic acid;hydrochloride
CID 17156907
N-[2-[(tert-butylamino)methyl]phenyl]acetamide
CID 66385215
N-[2-[[(2-methylcyclohexyl)methylamino]methyl]phenyl]acetamide
CID 66419232

Frequently Asked Questions

What is the IUPAC name of N-[2-[(cyclohexylamino)methyl]phenyl]acetamide?
The IUPAC name of N-[2-[(cyclohexylamino)methyl]phenyl]acetamide (CID 66289861) is N-[2-[(cyclohexylamino)methyl]phenyl]acetamide.
What is the SMILES notation for N-[2-[(cyclohexylamino)methyl]phenyl]acetamide?
The canonical SMILES for N-[2-[(cyclohexylamino)methyl]phenyl]acetamide is CC(=O)Nc1ccccc1CNC1CCCCC1.
What is the InChIKey of N-[2-[(cyclohexylamino)methyl]phenyl]acetamide?
The InChIKey is DUEMHMOSIOXPOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-12(18)17-15-10-6-5-7-13(15)11-16-14-8-3-2-4-9-14/h5-7,10,14,16H,2-4,8-9,11H2,1H3,(H,17,18).
What are the key properties of N-[2-[(cyclohexylamino)methyl]phenyl]acetamide?
N-[2-[(cyclohexylamino)methyl]phenyl]acetamide has a molecular weight of 246.35 g/mol, XLogP of 3.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(cyclohexylamino)methyl]phenyl]acetamide is sourced from PubChem (CID 66289861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).