4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride

C20H23ClN2O — CID 119728161

IUPAC4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride
SMILESCl.Nc1ccc(C(=O)N(C2CC2)C2CCCc3ccccc32)cc1
InChIInChI=1S/C20H22N2O.ClH/c21-16-10-8-15(9-11-16)20(23)22(17-12-13-17)19-7-3-5-14-4-1-2-6-18(14)19;/h1-2,4,6,8-11,17,19H,3,5,7,12-13,21H2;1H
InChIKeyZRLXGKLGEJTBPY-UHFFFAOYSA-N
MW342.87 g/mol
LogP4.37
Rot. Bonds3

About 4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride

4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride (PubChem CID 119728161) has the molecular formula C20H23ClN2O and a molecular weight of 342.87 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride
PubChem CID119728161
Molecular FormulaC20H23ClN2O
Molecular Weight342.87 g/mol
Exact Mass342.15
IUPAC Name4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride
SMILESCl.Nc1ccc(C(=O)N(C2CC2)C2CCCc3ccccc32)cc1
InChIInChI=1S/C20H22N2O.ClH/c21-16-10-8-15(9-11-16)20(23)22(17-12-13-17)19-7-3-5-14-4-1-2-6-18(14)19;/h1-2,4,6,8-11,17,19H,3,5,7,12-13,21H2;1H
InChIKeyZRLXGKLGEJTBPY-UHFFFAOYSA-N
XLogP4.37
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.87
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-cyclopropyl-4-pyrazol-1-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 55592536
3-amino-N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)benzamide;hydrochloride
CID 119742632
N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)thiophene-2-carboxamide
CID 75807762
2-(4-aminophenyl)-N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)acetamide;hydrochloride
CID 119742610
N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)-4-methylsulfinylbenzamide
CID 56822012
4-amino-N-(2,3-dihydro-1H-inden-1-yl)-N-methylbenzamide
CID 43575493
3-(2-aminophenyl)-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide;hydrochloride
CID 120609184
2-N,2-N,5-N,5-N-tetrakis(1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-2,5-dicarboxamide
CID 54416285
4-(cyclopropanecarbonylamino)-N-cyclopropyl-N-(2,3-dihydro-1H-inden-1-yl)benzamide
CID 71885135
7-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)heptanamide;hydrochloride
CID 119728149
4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide;hydrochloride
CID 120560475
4-chloro-N-[3-[cyclopropyl(1,2,3,4-tetrahydronaphthalen-1-yl)amino]-3-oxopropyl]benzamide
CID 55592636

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride?
The IUPAC name of 4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride (CID 119728161) is 4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride.
What is the SMILES notation for 4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride?
The canonical SMILES for 4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride is Cl.Nc1ccc(C(=O)N(C2CC2)C2CCCc3ccccc32)cc1.
What is the InChIKey of 4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride?
The InChIKey is ZRLXGKLGEJTBPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O.ClH/c21-16-10-8-15(9-11-16)20(23)22(17-12-13-17)19-7-3-5-14-4-1-2-6-18(14)19;/h1-2,4,6,8-11,17,19H,3,5,7,12-13,21H2;1H.
What are the key properties of 4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride?
4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride has a molecular weight of 342.87 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide;hydrochloride is sourced from PubChem (CID 119728161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).