1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride

C17H23Cl2N3O — CID 119840573

IUPAC1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride
SMILESCl.Cl.NC1(C(=O)NCCc2cccc3cccnc23)CCCC1
InChIInChI=1S/C17H21N3O.2ClH/c18-17(9-1-2-10-17)16(21)20-12-8-14-6-3-5-13-7-4-11-19-15(13)14;;/h3-7,11H,1-2,8-10,12,18H2,(H,20,21);2*1H
InChIKeyNNPKJWLBJQSZJB-UHFFFAOYSA-N
MW356.30 g/mol
LogP3.01
Rot. Bonds4

About 1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride

1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride (PubChem CID 119840573) has the molecular formula C17H23Cl2N3O and a molecular weight of 356.30 g/mol. Its IUPAC name is 1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride.

Molecular Properties

Compound Name1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride
PubChem CID119840573
Molecular FormulaC17H23Cl2N3O
Molecular Weight356.30 g/mol
Exact Mass355.12
IUPAC Name1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride
SMILESCl.Cl.NC1(C(=O)NCCc2cccc3cccnc23)CCCC1
InChIInChI=1S/C17H21N3O.2ClH/c18-17(9-1-2-10-17)16(21)20-12-8-14-6-3-5-13-7-4-11-19-15(13)14;;/h3-7,11H,1-2,8-10,12,18H2,(H,20,21);2*1H
InChIKeyNNPKJWLBJQSZJB-UHFFFAOYSA-N
XLogP3.01
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.30
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-(2-quinolin-8-ylethyl)propanamide
CID 78983595
N-(2-quinolin-8-ylethyl)cyclohexanecarboxamide
CID 18149258
methyl N-(2-quinolin-8-ylethyl)carbamate
CID 115577084
2-[2-oxo-2-(2-quinolin-8-ylethylamino)ethoxy]-N-(2-quinolin-8-ylethyl)acetamide
CID 78847250
(2S)-2-amino-3-methyl-N-(2-quinolin-8-ylethyl)butanamide
CID 81427163
1-amino-N-[2-(2-fluorophenyl)ethyl]cyclopentane-1-carboxamide
CID 60867022
2-(4-methoxyphenyl)-N-(2-quinolin-8-ylethyl)acetamide
CID 18149265
1-amino-N-(2-pyridin-2-ylethyl)cyclohexane-1-carboxamide
CID 24704991
3-chloro-N-(2-quinolin-8-ylethyl)propanamide
CID 81427870
(E)-N-(2-quinolin-8-ylethyl)but-2-enamide
CID 112723855
4-amino-2-methyl-N-(2-quinolin-8-ylethyl)butanamide
CID 81427876
2-naphthalen-2-yl-N-(2-quinolin-8-ylethyl)acetamide
CID 51112165

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride?
The IUPAC name of 1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride (CID 119840573) is 1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride.
What is the SMILES notation for 1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride?
The canonical SMILES for 1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride is Cl.Cl.NC1(C(=O)NCCc2cccc3cccnc23)CCCC1.
What is the InChIKey of 1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride?
The InChIKey is NNPKJWLBJQSZJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O.2ClH/c18-17(9-1-2-10-17)16(21)20-12-8-14-6-3-5-13-7-4-11-19-15(13)14;;/h3-7,11H,1-2,8-10,12,18H2,(H,20,21);2*1H.
What are the key properties of 1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride?
1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride has a molecular weight of 356.30 g/mol, XLogP of 3.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(2-quinolin-8-ylethyl)cyclopentane-1-carboxamide;dihydrochloride is sourced from PubChem (CID 119840573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).