(1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride

C13H19ClN2O — CID 45261492

IUPAC(1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride
SMILESCN(C)C(=O)[C@]1(c2ccccc2)CC1CN.Cl
InChIInChI=1S/C13H18N2O.ClH/c1-15(2)12(16)13(8-11(13)9-14)10-6-4-3-5-7-10;/h3-7,11H,8-9,14H2,1-2H3;1H/t11?,13-;/m0./s1
InChIKeyGIEDFGXZKMSAJZ-IYWIJXFJSA-N
MW254.76 g/mol
LogP1.41
Rot. Bonds3

About (1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride

(1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride (PubChem CID 45261492) has the molecular formula C13H19ClN2O and a molecular weight of 254.76 g/mol. Its IUPAC name is (1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name(1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride
PubChem CID45261492
Molecular FormulaC13H19ClN2O
Molecular Weight254.76 g/mol
Exact Mass254.12
IUPAC Name(1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride
SMILESCN(C)C(=O)[C@]1(c2ccccc2)CC1CN.Cl
InChIInChI=1S/C13H18N2O.ClH/c1-15(2)12(16)13(8-11(13)9-14)10-6-4-3-5-7-10;/h3-7,11H,8-9,14H2,1-2H3;1H/t11?,13-;/m0./s1
InChIKeyGIEDFGXZKMSAJZ-IYWIJXFJSA-N
XLogP1.41
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.76
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride?
The IUPAC name of (1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride (CID 45261492) is (1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride.
What is the SMILES notation for (1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride?
The canonical SMILES for (1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride is CN(C)C(=O)[C@]1(c2ccccc2)CC1CN.Cl.
What is the InChIKey of (1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride?
The InChIKey is GIEDFGXZKMSAJZ-IYWIJXFJSA-N. The full InChI is InChI=1S/C13H18N2O.ClH/c1-15(2)12(16)13(8-11(13)9-14)10-6-4-3-5-7-10;/h3-7,11H,8-9,14H2,1-2H3;1H/t11?,13-;/m0./s1.
What are the key properties of (1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride?
(1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride has a molecular weight of 254.76 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-(aminomethyl)-N,N-dimethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride is sourced from PubChem (CID 45261492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).