2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride

C13H19ClN2O — CID 119315817

IUPAC2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride
SMILESCc1ccccc1C1(CNC(=O)CN)CC1.Cl
InChIInChI=1S/C13H18N2O.ClH/c1-10-4-2-3-5-11(10)13(6-7-13)9-15-12(16)8-14;/h2-5H,6-9,14H2,1H3,(H,15,16);1H
InChIKeyGFMPHPCGYRTGRO-UHFFFAOYSA-N
MW254.76 g/mol
LogP1.52
Rot. Bonds4

About 2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride

2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride (PubChem CID 119315817) has the molecular formula C13H19ClN2O and a molecular weight of 254.76 g/mol. Its IUPAC name is 2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride
PubChem CID119315817
Molecular FormulaC13H19ClN2O
Molecular Weight254.76 g/mol
Exact Mass254.12
IUPAC Name2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride
SMILESCc1ccccc1C1(CNC(=O)CN)CC1.Cl
InChIInChI=1S/C13H18N2O.ClH/c1-10-4-2-3-5-11(10)13(6-7-13)9-15-12(16)8-14;/h2-5H,6-9,14H2,1H3,(H,15,16);1H
InChIKeyGFMPHPCGYRTGRO-UHFFFAOYSA-N
XLogP1.52
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.76
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclohexane-1-carboxamide
CID 119315839
2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 110459326
2-[[1-(2-methylphenyl)cyclopropyl]methylcarbamoylamino]propanediamide
CID 52910224
1-hydroxy-N-[[1-(2-methylphenyl)cyclopropyl]methyl]cyclopentane-1-carboxamide
CID 110922755
2-chloro-N-[[4-(2-methylphenyl)oxan-4-yl]methyl]acetamide
CID 154856535
7-amino-N-[[4-(2-methylphenyl)oxan-4-yl]methyl]heptanamide
CID 119749786
2-amino-N-[[4-(2-chlorophenyl)oxan-4-yl]methyl]acetamide;hydrochloride
CID 119320209
3-amino-N-[[4-(2-methylphenyl)oxan-4-yl]methyl]butanamide
CID 119749830
2-methyl-1-[[1-(2-methylphenyl)cyclopropyl]methyl]guanidine;hydroiodide
CID 110928186
2-(aminomethyl)-N-[[1-(2-methylphenyl)cyclopropyl]methyl]-1,3-thiazole-4-carboxamide;hydrochloride
CID 119770275
2-(4-aminophenyl)-N-[[4-(2-methylphenyl)oxan-4-yl]methyl]acetamide
CID 119749794
trans-(1R,2R)-2-methyl-N-[3-[[1-(2-methylphenyl)cyclopropyl]methylamino]-3-oxopropyl]cyclopropane-1-carboxamide
CID 95281523

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride?
The IUPAC name of 2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride (CID 119315817) is 2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride is Cc1ccccc1C1(CNC(=O)CN)CC1.Cl.
What is the InChIKey of 2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride?
The InChIKey is GFMPHPCGYRTGRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O.ClH/c1-10-4-2-3-5-11(10)13(6-7-13)9-15-12(16)8-14;/h2-5H,6-9,14H2,1H3,(H,15,16);1H.
What are the key properties of 2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride?
2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride has a molecular weight of 254.76 g/mol, XLogP of 1.52, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[1-(2-methylphenyl)cyclopropyl]methyl]acetamide;hydrochloride is sourced from PubChem (CID 119315817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).