2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide

C20H21N3O2 — CID 110623614

IUPAC2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide
SMILESCC(C(=O)Nc1ccc2c(c1)N(C(=O)c1cccnc1)CC2)C1CC1
InChIInChI=1S/C20H21N3O2/c1-13(14-4-5-14)19(24)22-17-7-6-15-8-10-23(18(15)11-17)20(25)16-3-2-9-21-12-16/h2-3,6-7,9,11-14H,4-5,8,10H2,1H3,(H,22,24)
InChIKeyXVMVCFKDOAZWEM-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.27
Rot. Bonds4

About 2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide

2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide (PubChem CID 110623614) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is 2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide
PubChem CID110623614
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC Name2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide
SMILESCC(C(=O)Nc1ccc2c(c1)N(C(=O)c1cccnc1)CC2)C1CC1
InChIInChI=1S/C20H21N3O2/c1-13(14-4-5-14)19(24)22-17-7-6-15-8-10-23(18(15)11-17)20(25)16-3-2-9-21-12-16/h2-3,6-7,9,11-14H,4-5,8,10H2,1H3,(H,22,24)
InChIKeyXVMVCFKDOAZWEM-UHFFFAOYSA-N
XLogP3.27
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]pyridine-4-carboxamide
CID 112506253
1-butan-2-yl-3-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]urea
CID 110623609
ethyl 2-oxo-2-[[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]amino]acetate
CID 112506255
2-amino-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]acetamide
CID 22689805
(2S)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]oxolane-2-carboxamide
CID 42344151
(E)-2-methyl-3-phenyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]prop-2-enamide
CID 110303995
1-(2-methoxyethyl)-3-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]urea
CID 110303998
6-oxo-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-7-yl]-1H-pyridine-3-carboxamide
CID 110623360
2-amino-2-methyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]propanamide
CID 119888320
cis-(1R,3S)-2,2-dimethyl-3-[[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]carbamoyl]cyclopropane-1-carboxylic acid
CID 95391406
(2S,4S)-2-methyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]piperidine-4-carboxamide;hydrochloride
CID 120636790
4-methyl-N-[1-(pyridine-3-carbonyl)-3,4-dihydro-2H-quinolin-6-yl]benzamide
CID 112505958

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide?
The IUPAC name of 2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide (CID 110623614) is 2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide.
What is the SMILES notation for 2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide?
The canonical SMILES for 2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide is CC(C(=O)Nc1ccc2c(c1)N(C(=O)c1cccnc1)CC2)C1CC1.
What is the InChIKey of 2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide?
The InChIKey is XVMVCFKDOAZWEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c1-13(14-4-5-14)19(24)22-17-7-6-15-8-10-23(18(15)11-17)20(25)16-3-2-9-21-12-16/h2-3,6-7,9,11-14H,4-5,8,10H2,1H3,(H,22,24).
What are the key properties of 2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide?
2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide has a molecular weight of 335.41 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-6-yl]propanamide is sourced from PubChem (CID 110623614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).