N-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide

C16H22N2O — CID 80567392

IUPACN-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide
SMILESCC1(C)C(NC(=O)C2Cc3ccccc3N2)C1(C)C
InChIInChI=1S/C16H22N2O/c1-15(2)14(16(15,3)4)18-13(19)12-9-10-7-5-6-8-11(10)17-12/h5-8,12,14,17H,9H2,1-4H3,(H,18,19)
InChIKeyMZXPSULUHSCRQG-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.57
Rot. Bonds2

About N-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide

N-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 80567392) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is N-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide
PubChem CID80567392
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC NameN-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide
SMILESCC1(C)C(NC(=O)C2Cc3ccccc3N2)C1(C)C
InChIInChI=1S/C16H22N2O/c1-15(2)14(16(15,3)4)18-13(19)12-9-10-7-5-6-8-11(10)17-12/h5-8,12,14,17H,9H2,1-4H3,(H,18,19)
InChIKeyMZXPSULUHSCRQG-UHFFFAOYSA-N
XLogP2.57
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-hydroxy-2,3-dihydro-1H-indole-2-carboxamide
CID 77014605
2-[[(2S)-2,3-dihydro-1H-indole-2-carbonyl]amino]-1-methylcyclopentane-1-carboxylic acid
CID 82763842
(2S)-N-[(1S,2S)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indole-2-carboxamide
CID 107221687
N-(2-methylcyclopentyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 76993656
2,3-dihydro-1H-indole-2-carboxylic acid;methanol
CID 174391428
N-methylsulfonyl-2,3-dihydro-1H-indole-2-carboxamide
CID 103287754
bis(2,3-dihydro-1H-indol-2-yl)methanone
CID 174436301
(2R)-2-[[(2S)-2,3-dihydro-1H-indole-2-carbonyl]amino]propanoic acid
CID 54991181
3-(2,3-dihydro-1H-indole-2-carbonylamino)cyclopentane-1-carboxylic acid
CID 77110035
(2S)-N-(1-ethylpiperidin-4-yl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61156890
N-[(3-methyloxetan-3-yl)methyl]-2,3-dihydro-1H-indole-2-carboxamide
CID 80567431
(2S)-N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide
CID 106188200

Frequently Asked Questions

What is the IUPAC name of N-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide?
The IUPAC name of N-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide (CID 80567392) is N-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide.
What is the SMILES notation for N-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide?
The canonical SMILES for N-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide is CC1(C)C(NC(=O)C2Cc3ccccc3N2)C1(C)C.
What is the InChIKey of N-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide?
The InChIKey is MZXPSULUHSCRQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-15(2)14(16(15,3)4)18-13(19)12-9-10-7-5-6-8-11(10)17-12/h5-8,12,14,17H,9H2,1-4H3,(H,18,19).
What are the key properties of N-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide?
N-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 258.36 g/mol, XLogP of 2.57, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,3,3-tetramethylcyclopropyl)-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 80567392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).