2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride

C15H23ClN2O — CID 119276377

IUPAC2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride
SMILESCCCC(N)C(=O)NCC1(c2ccccc2)CC1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-2-6-13(16)14(18)17-11-15(9-10-15)12-7-4-3-5-8-12;/h3-5,7-8,13H,2,6,9-11,16H2,1H3,(H,17,18);1H
InChIKeyHMALDJALXSMHID-UHFFFAOYSA-N
MW282.82 g/mol
LogP2.38
Rot. Bonds6

About 2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride

2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride (PubChem CID 119276377) has the molecular formula C15H23ClN2O and a molecular weight of 282.82 g/mol. Its IUPAC name is 2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride
PubChem CID119276377
Molecular FormulaC15H23ClN2O
Molecular Weight282.82 g/mol
Exact Mass282.15
IUPAC Name2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride
SMILESCCCC(N)C(=O)NCC1(c2ccccc2)CC1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-2-6-13(16)14(18)17-11-15(9-10-15)12-7-4-3-5-8-12;/h3-5,7-8,13H,2,6,9-11,16H2,1H3,(H,17,18);1H
InChIKeyHMALDJALXSMHID-UHFFFAOYSA-N
XLogP2.38
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.82
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide
CID 119293600
2-amino-N-[[1-(4-bromophenyl)cyclobutyl]methyl]pentanamide;hydrochloride
CID 119301083
(2R)-2-amino-N-[(1-phenylcycloheptyl)methyl]propanamide;hydrochloride
CID 119316389
2-amino-N-benzylpentanamide
CID 11020044
1-[(2-aminopentanoylamino)methyl]cyclopropane-1-carboxylic acid
CID 115450692
2-amino-2-methyl-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride
CID 119699195
2-(diethylamino)-2-phenyl-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 56538633
(2R,3S)-2-(carbamoylamino)-3-methyl-N-[(1-phenylcyclopropyl)methyl]pentanamide
CID 94615950
(2S)-2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-4-methylsulfanylbutanamide
CID 119293591
3-amino-N-[(4-phenyloxan-4-yl)methyl]butanamide
CID 119731118
(2S)-2-amino-N-[[1-(3-bromophenyl)cyclopropyl]methyl]-4-methylsulfanylbutanamide
CID 119325122
1-methoxy-3-[(1-phenylcyclopropyl)methyl]urea
CID 47159768

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride?
The IUPAC name of 2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride (CID 119276377) is 2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride?
The canonical SMILES for 2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride is CCCC(N)C(=O)NCC1(c2ccccc2)CC1.Cl.
What is the InChIKey of 2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride?
The InChIKey is HMALDJALXSMHID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-2-6-13(16)14(18)17-11-15(9-10-15)12-7-4-3-5-8-12;/h3-5,7-8,13H,2,6,9-11,16H2,1H3,(H,17,18);1H.
What are the key properties of 2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride?
2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride has a molecular weight of 282.82 g/mol, XLogP of 2.38, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride is sourced from PubChem (CID 119276377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).