N-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide

C14H20N2O — CID 43142404

IUPACN-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide
SMILESCCC(C)(C)NC(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C14H20N2O/c1-4-14(2,3)16-13(17)11-5-6-12-10(9-11)7-8-15-12/h5-6,9,15H,4,7-8H2,1-3H3,(H,16,17)
InChIKeyHCOFTFKJYSBPFV-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.57
Rot. Bonds3

About N-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide

N-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide (PubChem CID 43142404) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide
PubChem CID43142404
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide
SMILESCCC(C)(C)NC(=O)c1ccc2c(c1)CCN2
InChIInChI=1S/C14H20N2O/c1-4-14(2,3)16-13(17)11-5-6-12-10(9-11)7-8-15-12/h5-6,9,15H,4,7-8H2,1-3H3,(H,16,17)
InChIKeyHCOFTFKJYSBPFV-UHFFFAOYSA-N
XLogP2.57
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2,3-dihydro-1H-indole-5-carboxamide
CID 107852754
N-(2-hydroxy-2-methylbutyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 65106509
2-ethyl-2-(1,2,3,4-tetrahydroquinoline-6-carbonylamino)butanoic acid
CID 79814554
N-ethoxy-2,3-dihydro-1H-indole-5-carboxamide
CID 64974739
N-[2-(dimethylamino)-2-methylpropyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 61247768
N-(2-methoxy-2-methylpropyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 104761350
N-(2-hydroxy-2,4-dimethylpentyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 66171666
N-pentyl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142455
N-cyclopropyl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142413
N-(4-ethylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 61470340
N-(2-acetamidoethyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 43552874
N-[(2S)-2-hydroxypropyl]-2,3-dihydro-1H-indole-5-carboxamide
CID 93083353

Frequently Asked Questions

What is the IUPAC name of N-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide?
The IUPAC name of N-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide (CID 43142404) is N-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide.
What is the SMILES notation for N-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide?
The canonical SMILES for N-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide is CCC(C)(C)NC(=O)c1ccc2c(c1)CCN2.
What is the InChIKey of N-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide?
The InChIKey is HCOFTFKJYSBPFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-4-14(2,3)16-13(17)11-5-6-12-10(9-11)7-8-15-12/h5-6,9,15H,4,7-8H2,1-3H3,(H,16,17).
What are the key properties of N-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide?
N-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide has a molecular weight of 232.33 g/mol, XLogP of 2.57, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylbutan-2-yl)-2,3-dihydro-1H-indole-5-carboxamide is sourced from PubChem (CID 43142404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).