2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride

C15H25ClN2O2 — CID 119335294

IUPAC2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)NC(C)COCc1ccccc1.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-3-7-14(16)15(18)17-12(2)10-19-11-13-8-5-4-6-9-13;/h4-6,8-9,12,14H,3,7,10-11,16H2,1-2H3,(H,17,18);1H
InChIKeyPJIKQSFIAJSSGI-UHFFFAOYSA-N
MW300.83 g/mol
LogP2.26
Rot. Bonds8

About 2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride

2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride (PubChem CID 119335294) has the molecular formula C15H25ClN2O2 and a molecular weight of 300.83 g/mol. Its IUPAC name is 2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride
PubChem CID119335294
Molecular FormulaC15H25ClN2O2
Molecular Weight300.83 g/mol
Exact Mass300.16
IUPAC Name2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride
SMILESCCCC(N)C(=O)NC(C)COCc1ccccc1.Cl
InChIInChI=1S/C15H24N2O2.ClH/c1-3-7-14(16)15(18)17-12(2)10-19-11-13-8-5-4-6-9-13;/h4-6,8-9,12,14H,3,7,10-11,16H2,1-2H3,(H,17,18);1H
InChIKeyPJIKQSFIAJSSGI-UHFFFAOYSA-N
XLogP2.26
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.83
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-(1-phenylmethoxypropan-2-yl)propanamide;hydrochloride
CID 119335271
3-amino-2-methyl-N-(1-phenylmethoxypropan-2-yl)butanamide
CID 120501631
2-amino-N-(2-methyl-3-phenylmethoxypropyl)pentanamide;hydrochloride
CID 119304384
benzyl N-[1-(2-phenylmethoxyethoxy)propan-2-yl]carbamate
CID 146517395
2-amino-N-(1-phenylmethoxypropan-2-yl)acetamide
CID 119335277
2-(methylamino)-N-(1-phenylmethoxypropan-2-yl)acetamide;hydrochloride
CID 119804051
(2S)-2-amino-3-phenylmethoxy-N-propylpropanamide
CID 131854794
benzyl N-(1-aminobutyl)carbamate
CID 3840640
methyl (2S)-2-amino-3-phenylmethoxypropanoate;hydrochloride
CID 44630138
methyl (2R)-2-amino-3-phenylmethoxypropanoate;hydrochloride
CID 119088438
2-amino-N-(2-oxopropyl)-3-phenylmethoxypropanamide
CID 143126670
(3S)-3-amino-4-oxo-4-[[(2S)-1-oxo-1,3-bis(phenylmethoxy)propan-2-yl]amino]butanoic acid
CID 15922425

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride (CID 119335294) is 2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride is CCCC(N)C(=O)NC(C)COCc1ccccc1.Cl.
What is the InChIKey of 2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride?
The InChIKey is PJIKQSFIAJSSGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2.ClH/c1-3-7-14(16)15(18)17-12(2)10-19-11-13-8-5-4-6-9-13;/h4-6,8-9,12,14H,3,7,10-11,16H2,1-2H3,(H,17,18);1H.
What are the key properties of 2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride?
2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride has a molecular weight of 300.83 g/mol, XLogP of 2.26, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-phenylmethoxypropan-2-yl)pentanamide;hydrochloride is sourced from PubChem (CID 119335294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).