N-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride

C13H19ClN2O — CID 119382194

IUPACN-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride
SMILESCl.NCCNC(=O)c1ccc2c(c1)CCCC2
InChIInChI=1S/C13H18N2O.ClH/c14-7-8-15-13(16)12-6-5-10-3-1-2-4-11(10)9-12;/h5-6,9H,1-4,7-8,14H2,(H,15,16);1H
InChIKeyWTUWYSJUQAQPSA-UHFFFAOYSA-N
MW254.76 g/mol
LogP1.68
Rot. Bonds3

About N-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride

N-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride (PubChem CID 119382194) has the molecular formula C13H19ClN2O and a molecular weight of 254.76 g/mol. Its IUPAC name is N-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride
PubChem CID119382194
Molecular FormulaC13H19ClN2O
Molecular Weight254.76 g/mol
Exact Mass254.12
IUPAC NameN-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride
SMILESCl.NCCNC(=O)c1ccc2c(c1)CCCC2
InChIInChI=1S/C13H18N2O.ClH/c14-7-8-15-13(16)12-6-5-10-3-1-2-4-11(10)9-12;/h5-6,9H,1-4,7-8,14H2,(H,15,16);1H
InChIKeyWTUWYSJUQAQPSA-UHFFFAOYSA-N
XLogP1.68
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.76
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-aminoethylcarbamoyl)phenyl]-2,3-dihydro-1H-indene-5-carboxamide
CID 120604023
N-(2-methylsulfonylethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 60545524
3-(2,3-dihydro-1H-indene-5-carbonylamino)propanoic acid
CID 18071901
3-(2-aminocyclohexen-1-yl)-N-(2-aminoethyl)-4-methylbenzamide
CID 156841400
N-(2-amino-2-oxoethyl)-2,3-dihydro-1H-indene-5-carboxamide
CID 9295424
N-(3-pyrrolidin-1-ylpropyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 95166108
N-(4-amino-4-sulfanylidenebutyl)-2,3-dihydro-1H-indene-5-carboxamide
CID 55102214
1-N,4-N-bis(2-aminoethyl)benzene-1,4-dicarboxamide
CID 58098446
3-(2,3-dihydro-1H-indene-5-carbonylamino)-2-methylpropanoic acid
CID 55105106
N-(2-cyclopentylsulfanylethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 100706753
N-[2-(2-fluorophenyl)ethyl]-2,3-dihydro-1H-indene-5-carboxamide
CID 9100118
N-(3-ethoxypropyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 95903042

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride?
The IUPAC name of N-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride (CID 119382194) is N-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride?
The canonical SMILES for N-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride is Cl.NCCNC(=O)c1ccc2c(c1)CCCC2.
What is the InChIKey of N-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride?
The InChIKey is WTUWYSJUQAQPSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O.ClH/c14-7-8-15-13(16)12-6-5-10-3-1-2-4-11(10)9-12;/h5-6,9H,1-4,7-8,14H2,(H,15,16);1H.
What are the key properties of N-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride?
N-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride has a molecular weight of 254.76 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride is sourced from PubChem (CID 119382194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).