N-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride

C17H27ClN2O — CID 119615543

IUPACN-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride
SMILESCC(C)Cc1ccc(CC(=O)NC(CN)C2CC2)cc1.Cl
InChIInChI=1S/C17H26N2O.ClH/c1-12(2)9-13-3-5-14(6-4-13)10-17(20)19-16(11-18)15-7-8-15;/h3-6,12,15-16H,7-11,18H2,1-2H3,(H,19,20);1H
InChIKeyQIKSQCKWMJEWJN-UHFFFAOYSA-N
MW310.87 g/mol
LogP2.70
Rot. Bonds7

About N-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride

N-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride (PubChem CID 119615543) has the molecular formula C17H27ClN2O and a molecular weight of 310.87 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride
PubChem CID119615543
Molecular FormulaC17H27ClN2O
Molecular Weight310.87 g/mol
Exact Mass310.18
IUPAC NameN-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride
SMILESCC(C)Cc1ccc(CC(=O)NC(CN)C2CC2)cc1.Cl
InChIInChI=1S/C17H26N2O.ClH/c1-12(2)9-13-3-5-14(6-4-13)10-17(20)19-16(11-18)15-7-8-15;/h3-6,12,15-16H,7-11,18H2,1-2H3,(H,19,20);1H
InChIKeyQIKSQCKWMJEWJN-UHFFFAOYSA-N
XLogP2.70
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.87
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-1-cyclopropylethyl)-3-(4-ethylphenyl)butanamide;hydrochloride
CID 119613872
2-[4-(2-methylpropyl)phenyl]-N-propan-2-ylacetamide
CID 78814712
N-(2-amino-1-cyclohexylethyl)-2-[4-(difluoromethoxy)phenyl]acetamide;hydrochloride
CID 119590309
N-(2-amino-1-cyclopentylethyl)-2-(4-nitrophenyl)acetamide
CID 106737533
N-(2-amino-1-cyclopropylethyl)-2-methyl-3-[4-(trifluoromethyl)phenyl]propanamide;hydrochloride
CID 119613878
N-(2-amino-1-cyclopropylethyl)-2-(2,3-difluorophenyl)acetamide;hydrochloride
CID 119616566
N-(2-amino-1-cyclopropylethyl)-2-methyl-3-[4-(trifluoromethyl)phenyl]propanamide
CID 119613879
N-(2-amino-1-cyclohexylethyl)-2-(3,4-dimethoxyphenyl)acetamide
CID 119590262
N-(3-amino-2-methylpropyl)-2-[4-(2-methylpropyl)phenyl]acetamide
CID 115271670
N-(2-amino-1-cyclohexylethyl)-3-(4-methylphenyl)propanamide;hydrochloride
CID 119589025
N-(2-amino-1-cyclopentylethyl)-3-methylbutanamide
CID 106737373
3-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]butanoic acid
CID 119220881

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride (CID 119615543) is N-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride is CC(C)Cc1ccc(CC(=O)NC(CN)C2CC2)cc1.Cl.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride?
The InChIKey is QIKSQCKWMJEWJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O.ClH/c1-12(2)9-13-3-5-14(6-4-13)10-17(20)19-16(11-18)15-7-8-15;/h3-6,12,15-16H,7-11,18H2,1-2H3,(H,19,20);1H.
What are the key properties of N-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride?
N-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride has a molecular weight of 310.87 g/mol, XLogP of 2.70, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)-2-[4-(2-methylpropyl)phenyl]acetamide;hydrochloride is sourced from PubChem (CID 119615543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).