(3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride

C11H15Cl2N3O — CID 165430484

IUPAC(3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride
SMILESCl.N[C@@H]1CCN(C(=O)Nc2ccc(Cl)cc2)C1
InChIInChI=1S/C11H14ClN3O.ClH/c12-8-1-3-10(4-2-8)14-11(16)15-6-5-9(13)7-15;/h1-4,9H,5-7,13H2,(H,14,16);1H/t9-;/m1./s1
InChIKeyUAZZFVPODSOPSZ-SBSPUUFOSA-N
MW276.17 g/mol
LogP2.33
Rot. Bonds1

About (3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride

(3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride (PubChem CID 165430484) has the molecular formula C11H15Cl2N3O and a molecular weight of 276.17 g/mol. Its IUPAC name is (3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name(3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride
PubChem CID165430484
Molecular FormulaC11H15Cl2N3O
Molecular Weight276.17 g/mol
Exact Mass275.06
IUPAC Name(3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride
SMILESCl.N[C@@H]1CCN(C(=O)Nc2ccc(Cl)cc2)C1
InChIInChI=1S/C11H14ClN3O.ClH/c12-8-1-3-10(4-2-8)14-11(16)15-6-5-9(13)7-15;/h1-4,9H,5-7,13H2,(H,14,16);1H/t9-;/m1./s1
InChIKeyUAZZFVPODSOPSZ-SBSPUUFOSA-N
XLogP2.33
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.17
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-amino-N-(3,5-dichlorophenyl)pyrrolidine-1-carboxamide
CID 107654257
3-amino-N-(4-fluorophenyl)pyrrolidine-1-carboxamide
CID 62068743
(3R)-3-amino-N-phenylpyrrolidine-1-carboxamide
CID 94340040
(3S)-3-amino-N-(4-cyanophenyl)pyrrolidine-1-carboxamide
CID 113282408
N-(4-chlorophenyl)-4-(methylamino)piperidine-1-carboxamide;hydrochloride
CID 165430478
3-[(3R)-3-aminopyrrolidine-1-carbonyl]-N-(4-chlorophenyl)pyrazine-2-carboxamide;hydrochloride
CID 119412850
(3S)-3-amino-N-(2,5-dichlorophenyl)pyrrolidine-1-carboxamide
CID 113282412
(3R)-N-(4-chlorophenyl)-3-(hydroxymethyl)piperidine-1-carboxamide
CID 9120034
(3R,4S)-N-(4-chlorophenyl)-3,4-dihydroxypyrrolidine-1-carboxamide
CID 79411419
(3-aminopyrrolidin-1-yl)-(4-chlorophenyl)methanone
CID 59657899
4-amino-N-(4-fluorophenyl)piperidine-1-carboxamide
CID 16773171
N-(4-chlorophenyl)-4-cyanopiperidine-1-carboxamide
CID 60969957

Frequently Asked Questions

What is the IUPAC name of (3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride?
The IUPAC name of (3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride (CID 165430484) is (3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride.
What is the SMILES notation for (3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride?
The canonical SMILES for (3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride is Cl.N[C@@H]1CCN(C(=O)Nc2ccc(Cl)cc2)C1.
What is the InChIKey of (3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride?
The InChIKey is UAZZFVPODSOPSZ-SBSPUUFOSA-N. The full InChI is InChI=1S/C11H14ClN3O.ClH/c12-8-1-3-10(4-2-8)14-11(16)15-6-5-9(13)7-15;/h1-4,9H,5-7,13H2,(H,14,16);1H/t9-;/m1./s1.
What are the key properties of (3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride?
(3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride has a molecular weight of 276.17 g/mol, XLogP of 2.33, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-amino-N-(4-chlorophenyl)pyrrolidine-1-carboxamide;hydrochloride is sourced from PubChem (CID 165430484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).