(2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride

C19H22ClN3O — CID 119262851

IUPAC(2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride
SMILESCCn1c2ccccc2c2cc(NC(=O)[C@@H]3CCCN3)ccc21.Cl
InChIInChI=1S/C19H21N3O.ClH/c1-2-22-17-8-4-3-6-14(17)15-12-13(9-10-18(15)22)21-19(23)16-7-5-11-20-16;/h3-4,6,8-10,12,16,20H,2,5,7,11H2,1H3,(H,21,23);1H/t16-;/m0./s1
InChIKeyIWSDXJFZQPHPRG-NTISSMGPSA-N
MW343.86 g/mol
LogP3.93
Rot. Bonds3

About (2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride

(2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride (PubChem CID 119262851) has the molecular formula C19H22ClN3O and a molecular weight of 343.86 g/mol. Its IUPAC name is (2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name(2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride
PubChem CID119262851
Molecular FormulaC19H22ClN3O
Molecular Weight343.86 g/mol
Exact Mass343.15
IUPAC Name(2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride
SMILESCCn1c2ccccc2c2cc(NC(=O)[C@@H]3CCCN3)ccc21.Cl
InChIInChI=1S/C19H21N3O.ClH/c1-2-22-17-8-4-3-6-14(17)15-12-13(9-10-18(15)22)21-19(23)16-7-5-11-20-16;/h3-4,6,8-10,12,16,20H,2,5,7,11H2,1H3,(H,21,23);1H/t16-;/m0./s1
InChIKeyIWSDXJFZQPHPRG-NTISSMGPSA-N
XLogP3.93
TPSA46.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.86
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,4E)-N-(9-ethylcarbazol-3-yl)-4-methoxyiminopyrrolidine-2-carboxamide
CID 87752450
trans-(1S,2S)-1-N,2-N-bis(9-ethylcarbazol-3-yl)-3-methylidenecyclopropane-1,2-dicarboxamide
CID 2321929
1-acetyl-N-(9-ethylcarbazol-3-yl)piperidine-4-carboxamide
CID 17127014
N-(9-ethylcarbazol-3-yl)-2-sulfanylacetamide
CID 54424608
(2S,5R)-5-(aminomethyl)-N-(9-ethylcarbazol-3-yl)oxolane-2-carboxamide;hydrochloride
CID 120782901
(2R)-N-(9-ethylcarbazol-3-yl)-1-propylsulfonylpyrrolidine-2-carboxamide
CID 35740935
N-(3-methyl-2-oxo-1,3-benzoxazol-6-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 119312607
N-[4-(ethylsulfonylamino)phenyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119282547
N-(3-carbamoylphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119270285
N-[3-[1-[(9-ethylcarbazol-3-yl)amino]-1-oxopropan-2-yl]sulfanylphenyl]cyclohexanecarboxamide
CID 19299111
(3S)-1-[(2-chlorophenyl)methyl]-N-(9-ethylcarbazol-3-yl)piperidine-3-carboxamide
CID 38104218
N-(2H-benzotriazol-5-yl)pyrrolidine-2-carboxamide;hydrochloride
CID 119280134

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of (2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride (CID 119262851) is (2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for (2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for (2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride is CCn1c2ccccc2c2cc(NC(=O)[C@@H]3CCCN3)ccc21.Cl.
What is the InChIKey of (2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is IWSDXJFZQPHPRG-NTISSMGPSA-N. The full InChI is InChI=1S/C19H21N3O.ClH/c1-2-22-17-8-4-3-6-14(17)15-12-13(9-10-18(15)22)21-19(23)16-7-5-11-20-16;/h3-4,6,8-10,12,16,20H,2,5,7,11H2,1H3,(H,21,23);1H/t16-;/m0./s1.
What are the key properties of (2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride?
(2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 343.86 g/mol, XLogP of 3.93, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(9-ethylcarbazol-3-yl)pyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119262851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).