(2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide

C15H22N2O2 — CID 119330095

IUPAC(2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide
SMILESC[C@H](N)C(=O)Nc1ccc(COC2CCCC2)cc1
InChIInChI=1S/C15H22N2O2/c1-11(16)15(18)17-13-8-6-12(7-9-13)10-19-14-4-2-3-5-14/h6-9,11,14H,2-5,10,16H2,1H3,(H,17,18)/t11-/m0/s1
InChIKeyUPRYSEDZCCRDLU-NSHDSACASA-N
MW262.35 g/mol
LogP2.43
Rot. Bonds5

About (2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide

(2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide (PubChem CID 119330095) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is (2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide
PubChem CID119330095
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name(2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide
SMILESC[C@H](N)C(=O)Nc1ccc(COC2CCCC2)cc1
InChIInChI=1S/C15H22N2O2/c1-11(16)15(18)17-13-8-6-12(7-9-13)10-19-14-4-2-3-5-14/h6-9,11,14H,2-5,10,16H2,1H3,(H,17,18)/t11-/m0/s1
InChIKeyUPRYSEDZCCRDLU-NSHDSACASA-N
XLogP2.43
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[4-(cyclopentyloxymethyl)phenyl]-2-phenylacetamide;hydrochloride
CID 119330112
2-amino-N-[4-(cyclopentyloxymethyl)phenyl]acetamide;hydrochloride
CID 119330098
[4-[[(2S)-2-aminopropanoyl]amino]phenyl]methyl N-methylcarbamate
CID 166675608
N-[4-(cyclopentyloxymethyl)phenyl]-2-(methylamino)acetamide
CID 119795210
4-(aminomethyl)-N-[4-(cyclopentyloxymethyl)phenyl]benzamide
CID 119330109
[4-[[(2S)-2-aminopropanoyl]amino]phenyl]methyl formate
CID 155030194
(2R)-N-[4-[[acetyl(cyclopropyl)amino]methyl]phenyl]-2-aminopropanamide;hydrochloride
CID 119328523
2-[[4-(cyclopentyloxymethyl)phenyl]carbamoyl]cyclobutane-1-carboxylic acid
CID 120976294
(2S)-2-amino-N-[4-(hydroxymethyl)phenyl]propanamide
CID 103691721
3-amino-N-[4-(cyclopentyloxymethyl)phenyl]cyclopentane-1-carboxamide
CID 119795202
(2S)-2-amino-N-[4-[(dimethylamino)methyl]phenyl]propanamide
CID 61146186
N-[4-(cyclopentyloxymethyl)phenyl]-4-(methylamino)butanamide;hydrochloride
CID 119795197

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide?
The IUPAC name of (2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide (CID 119330095) is (2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide.
What is the SMILES notation for (2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide?
The canonical SMILES for (2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide is C[C@H](N)C(=O)Nc1ccc(COC2CCCC2)cc1.
What is the InChIKey of (2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide?
The InChIKey is UPRYSEDZCCRDLU-NSHDSACASA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11(16)15(18)17-13-8-6-12(7-9-13)10-19-14-4-2-3-5-14/h6-9,11,14H,2-5,10,16H2,1H3,(H,17,18)/t11-/m0/s1.
What are the key properties of (2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide?
(2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide has a molecular weight of 262.35 g/mol, XLogP of 2.43, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-[4-(cyclopentyloxymethyl)phenyl]propanamide is sourced from PubChem (CID 119330095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).