N-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride

C17H25ClN4O2 — CID 119801398

IUPACN-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride
SMILESCCNC(=O)N1CCc2ccc(NC(=O)CC3CCCN3)cc21.Cl
InChIInChI=1S/C17H24N4O2.ClH/c1-2-18-17(23)21-9-7-12-5-6-14(10-15(12)21)20-16(22)11-13-4-3-8-19-13;/h5-6,10,13,19H,2-4,7-9,11H2,1H3,(H,18,23)(H,20,22);1H
InChIKeyVVPBVPWGZCRWES-UHFFFAOYSA-N
MW352.87 g/mol
LogP2.28
Rot. Bonds4

About N-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride

N-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride (PubChem CID 119801398) has the molecular formula C17H25ClN4O2 and a molecular weight of 352.87 g/mol. Its IUPAC name is N-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride
PubChem CID119801398
Molecular FormulaC17H25ClN4O2
Molecular Weight352.87 g/mol
Exact Mass352.17
IUPAC NameN-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride
SMILESCCNC(=O)N1CCc2ccc(NC(=O)CC3CCCN3)cc21.Cl
InChIInChI=1S/C17H24N4O2.ClH/c1-2-18-17(23)21-9-7-12-5-6-14(10-15(12)21)20-16(22)11-13-4-3-8-19-13;/h5-6,10,13,19H,2-4,7-9,11H2,1H3,(H,18,23)(H,20,22);1H
InChIKeyVVPBVPWGZCRWES-UHFFFAOYSA-N
XLogP2.28
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.87
LogP ≤ 52.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]-2-pyrrolidin-2-ylacetamide
CID 119761289
N-(3,4-dimethylphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119670651
6-(2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonylamino)-N-ethyl-2,3-dihydroindole-1-carboxamide;hydrochloride
CID 119333739
N-(4-acetamidophenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119669050
6-[[2-(3,4-dimethyl-5-oxo-1,2,4-triazol-1-yl)acetyl]amino]-N-ethyl-2,3-dihydroindole-1-carboxamide
CID 136551032
N-ethyl-3-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
CID 61364037
6-amino-N-ethyl-2,3-dihydroindole-1-carboxamide
CID 43164814
2-piperidin-1-yl-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide;hydrochloride
CID 119786123
N-(3-methylphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119670441
(7R)-N-[1-(ethylcarbamoyl)-2,3-dihydroindol-6-yl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-7-carboxamide
CID 97028925
N-(3,4-dihydro-2H-chromen-6-yl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119767368
N-(4-chlorophenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119671239

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride?
The IUPAC name of N-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride (CID 119801398) is N-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride.
What is the SMILES notation for N-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride?
The canonical SMILES for N-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride is CCNC(=O)N1CCc2ccc(NC(=O)CC3CCCN3)cc21.Cl.
What is the InChIKey of N-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride?
The InChIKey is VVPBVPWGZCRWES-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2.ClH/c1-2-18-17(23)21-9-7-12-5-6-14(10-15(12)21)20-16(22)11-13-4-3-8-19-13;/h5-6,10,13,19H,2-4,7-9,11H2,1H3,(H,18,23)(H,20,22);1H.
What are the key properties of N-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride?
N-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride has a molecular weight of 352.87 g/mol, XLogP of 2.28, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-[(2-pyrrolidin-2-ylacetyl)amino]-2,3-dihydroindole-1-carboxamide;hydrochloride is sourced from PubChem (CID 119801398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).