2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide

C15H22N2O — CID 55030650

IUPAC2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide
SMILESCNC(=O)Cc1ccccc1NCC1CCCC1
InChIInChI=1S/C15H22N2O/c1-16-15(18)10-13-8-4-5-9-14(13)17-11-12-6-2-3-7-12/h4-5,8-9,12,17H,2-3,6-7,10-11H2,1H3,(H,16,18)
InChIKeyUTBPUASSSZASAD-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.58
Rot. Bonds5

About 2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide

2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide (PubChem CID 55030650) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide.

Molecular Properties

Compound Name2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide
PubChem CID55030650
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide
SMILESCNC(=O)Cc1ccccc1NCC1CCCC1
InChIInChI=1S/C15H22N2O/c1-16-15(18)10-13-8-4-5-9-14(13)17-11-12-6-2-3-7-12/h4-5,8-9,12,17H,2-3,6-7,10-11H2,1H3,(H,16,18)
InChIKeyUTBPUASSSZASAD-UHFFFAOYSA-N
XLogP2.58
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-2-[2-(piperidin-3-ylmethylamino)phenyl]acetamide
CID 80553694
2-[2-(cyclohex-3-en-1-ylmethylamino)phenyl]-N-methylacetamide
CID 43692145
methyl 2-(cyclopentylmethylamino)benzoate
CID 55030315
N-methyl-2-[2-[[2-(2-methylcyclohexyl)oxyacetyl]amino]phenyl]acetamide
CID 56789258
N-(cyclopentylmethyl)-2-(diethylaminomethyl)aniline
CID 55034710
methyl 2-(cyclohexylmethylamino)benzoate
CID 43087805
2-methyl-2-(methylamino)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]propanamide
CID 55121879
2-[2-[(2,3-dihydroxyphenyl)methylamino]phenyl]-N-methylacetamide
CID 61319910
N-methyl-2-[2-(3-methylbutan-2-ylamino)phenyl]acetamide
CID 43692244
2-[2-(heptylamino)phenyl]-N-methylacetamide
CID 43692231
(2S)-N-[2-[2-(methylamino)-2-oxoethyl]phenyl]pyrrolidine-2-carboxamide
CID 61179637
tert-butyl N-[2-(cycloheptylmethylamino)phenyl]carbamate
CID 107240333

Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide?
The IUPAC name of 2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide (CID 55030650) is 2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide.
What is the SMILES notation for 2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide?
The canonical SMILES for 2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide is CNC(=O)Cc1ccccc1NCC1CCCC1.
What is the InChIKey of 2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide?
The InChIKey is UTBPUASSSZASAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-16-15(18)10-13-8-4-5-9-14(13)17-11-12-6-2-3-7-12/h4-5,8-9,12,17H,2-3,6-7,10-11H2,1H3,(H,16,18).
What are the key properties of 2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide?
2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide has a molecular weight of 246.35 g/mol, XLogP of 2.58, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclopentylmethylamino)phenyl]-N-methylacetamide is sourced from PubChem (CID 55030650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).