N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide

C17H26N2O2 — CID 119714426

IUPACN-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide
SMILESCNCC(C)C(=O)NCc1ccccc1OC1CCCC1
InChIInChI=1S/C17H26N2O2/c1-13(11-18-2)17(20)19-12-14-7-3-6-10-16(14)21-15-8-4-5-9-15/h3,6-7,10,13,15,18H,4-5,8-9,11-12H2,1-2H3,(H,19,20)
InChIKeyRVNDSLUQWBIVPJ-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.48
Rot. Bonds7

About N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide

N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide (PubChem CID 119714426) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide.

Molecular Properties

Compound NameN-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide
PubChem CID119714426
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide
SMILESCNCC(C)C(=O)NCc1ccccc1OC1CCCC1
InChIInChI=1S/C17H26N2O2/c1-13(11-18-2)17(20)19-12-14-7-3-6-10-16(14)21-15-8-4-5-9-15/h3,6-7,10,13,15,18H,4-5,8-9,11-12H2,1-2H3,(H,19,20)
InChIKeyRVNDSLUQWBIVPJ-UHFFFAOYSA-N
XLogP2.48
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-[(2-cyclobutyloxyphenyl)methyl]propanamide
CID 119330644
N-(2-cyclopentyloxyphenyl)-2-methyl-3-(methylamino)propanamide
CID 119737329
N-[(2-cyclobutyloxyphenyl)methyl]-2-(methylamino)acetamide
CID 119796176
N-[[2-(cyclopropylmethoxy)phenyl]methyl]-2-methyl-3-(methylamino)propanamide
CID 119786909
2-[(2-cyclopentyloxyphenyl)methylamino]propanoic acid
CID 120913321
(2S)-2-amino-N-[(2-cyclobutyloxyphenyl)methyl]-3,3-dimethylbutanamide;hydrochloride
CID 119796181
2-amino-N-[(2-cyclobutyloxyphenyl)methyl]pentanamide
CID 119330646
2-amino-N-[(2-cyclopentyloxyphenyl)methyl]acetamide
CID 119284470
N-[(2-cycloheptyloxyphenyl)methyl]propan-2-amine
CID 82927515
3-amino-N-[(2-cyclopentyloxyphenyl)methyl]propanamide
CID 119284468
2-methyl-3-(methylamino)-N-[[2-(2,2,2-trifluoroethoxy)phenyl]methyl]propanamide
CID 119744421
2-[[(2-cyclopentyloxyphenyl)methylamino]methyl]-4-methylpentanoic acid
CID 122073187

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide?
The IUPAC name of N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide (CID 119714426) is N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide.
What is the SMILES notation for N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide?
The canonical SMILES for N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide is CNCC(C)C(=O)NCc1ccccc1OC1CCCC1.
What is the InChIKey of N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide?
The InChIKey is RVNDSLUQWBIVPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13(11-18-2)17(20)19-12-14-7-3-6-10-16(14)21-15-8-4-5-9-15/h3,6-7,10,13,15,18H,4-5,8-9,11-12H2,1-2H3,(H,19,20).
What are the key properties of N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide?
N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide has a molecular weight of 290.41 g/mol, XLogP of 2.48, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclopentyloxyphenyl)methyl]-2-methyl-3-(methylamino)propanamide is sourced from PubChem (CID 119714426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).