1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide

C16H18N2O2 — CID 53014581

IUPAC1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide
SMILESO=C(NC1CC1)c1cccc2c1CCN2C(=O)C1CC1
InChIInChI=1S/C16H18N2O2/c19-15(17-11-6-7-11)13-2-1-3-14-12(13)8-9-18(14)16(20)10-4-5-10/h1-3,10-11H,4-9H2,(H,17,19)
InChIKeyBJXPAVQQKQYSAK-UHFFFAOYSA-N
MW270.33 g/mol
LogP1.88
Rot. Bonds3

About 1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide

1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide (PubChem CID 53014581) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide.

Molecular Properties

Compound Name1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide
PubChem CID53014581
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide
SMILESO=C(NC1CC1)c1cccc2c1CCN2C(=O)C1CC1
InChIInChI=1S/C16H18N2O2/c19-15(17-11-6-7-11)13-2-1-3-14-12(13)8-9-18(14)16(20)10-4-5-10/h1-3,10-11H,4-9H2,(H,17,19)
InChIKeyBJXPAVQQKQYSAK-UHFFFAOYSA-N
XLogP1.88
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-1-(4-fluorobenzoyl)-2,3-dihydroindole-4-carboxamide
CID 53160038
1-(cyclopropanecarbonyl)-N-[(3,5-dimethoxyphenyl)methyl]-2,3-dihydroindole-4-carboxamide
CID 53159994
N-cyclopentyl-1-(cyclopropanecarbonyl)-2,3-dihydroindole-5-carboxamide
CID 53080886
1-(cyclohexanecarbonyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid
CID 45382534
2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide
CID 110819420
N-cyclohexyl-2-pyrrolidin-1-ylbenzamide
CID 168514596
N-ethyl-1-propanoyl-2,3-dihydroindole-4-carboxamide
CID 53159918
2-(4-aminopiperidin-1-yl)-N-cyclopropylbenzamide
CID 42656462
2-amino-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide;hydrochloride
CID 119944177
N-(cyclohexylmethyl)-1-propanoyl-2,3-dihydroindole-4-carboxamide
CID 53159922
(3-aminocyclopentyl)-(4-chloro-2,3-dihydroindol-1-yl)methanone;hydrochloride
CID 119788761
N-cyclopropyl-2,3-difluorobenzamide
CID 62648987

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide?
The IUPAC name of 1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide (CID 53014581) is 1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide.
What is the SMILES notation for 1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide?
The canonical SMILES for 1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide is O=C(NC1CC1)c1cccc2c1CCN2C(=O)C1CC1.
What is the InChIKey of 1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide?
The InChIKey is BJXPAVQQKQYSAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c19-15(17-11-6-7-11)13-2-1-3-14-12(13)8-9-18(14)16(20)10-4-5-10/h1-3,10-11H,4-9H2,(H,17,19).
What are the key properties of 1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide?
1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide has a molecular weight of 270.33 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropanecarbonyl)-N-cyclopropyl-2,3-dihydroindole-4-carboxamide is sourced from PubChem (CID 53014581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).