N-(dicyclopropylmethyl)-1H-indole-2-carboxamide

C16H18N2O — CID 47143820

IUPACN-(dicyclopropylmethyl)-1H-indole-2-carboxamide
SMILESO=C(NC(C1CC1)C1CC1)c1cc2ccccc2[nH]1
InChIInChI=1S/C16H18N2O/c19-16(18-15(10-5-6-10)11-7-8-11)14-9-12-3-1-2-4-13(12)17-14/h1-4,9-11,15,17H,5-8H2,(H,18,19)
InChIKeyWYBKIQDTKKMNRN-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.09
Rot. Bonds4

About N-(dicyclopropylmethyl)-1H-indole-2-carboxamide

N-(dicyclopropylmethyl)-1H-indole-2-carboxamide (PubChem CID 47143820) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-1H-indole-2-carboxamide
PubChem CID47143820
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-(dicyclopropylmethyl)-1H-indole-2-carboxamide
SMILESO=C(NC(C1CC1)C1CC1)c1cc2ccccc2[nH]1
InChIInChI=1S/C16H18N2O/c19-16(18-15(10-5-6-10)11-7-8-11)14-9-12-3-1-2-4-13(12)17-14/h1-4,9-11,15,17H,5-8H2,(H,18,19)
InChIKeyWYBKIQDTKKMNRN-UHFFFAOYSA-N
XLogP3.09
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1R)-1-cyanoethyl]-1H-indole-2-carboxamide
CID 95253875
3-cyclopropyl-3-[(5-phenyl-1H-indole-2-carbonyl)amino]propanoic acid
CID 167841934
N-(4-hydroxybutan-2-yl)-1H-indole-2-carboxamide
CID 81042932
N-[(2S)-1-(cyclododecylamino)-3-hydroxy-1-oxopropan-2-yl]-1H-indole-2-carboxamide
CID 6722885
N-(4-aminocyclohexyl)-1H-indole-2-carboxamide
CID 62318715
potassium N-oxido-1H-indole-2-carboxamide
CID 23661896
N-(8-azabicyclo[3.2.1]octan-3-yl)-1H-indole-2-carboxamide
CID 61237731
(2R)-4-hydroxy-2-(1H-indole-2-carbonylamino)butanoic acid
CID 107823080
2-cyclopropyl-2-[(4-oxo-1H-quinoline-2-carbonyl)amino]acetic acid
CID 62695160
N-[1-(cyclohexylmethylamino)-3-hydroxy-1-oxopropan-2-yl]-1H-indole-2-carboxamide
CID 3618702
N-(1-propan-2-ylpiperidin-4-yl)-1H-indole-2-carboxamide
CID 51219847
N-[1-(4-aminophenyl)ethyl]-1H-indole-2-carboxamide
CID 116650098

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-1H-indole-2-carboxamide?
The IUPAC name of N-(dicyclopropylmethyl)-1H-indole-2-carboxamide (CID 47143820) is N-(dicyclopropylmethyl)-1H-indole-2-carboxamide.
What is the SMILES notation for N-(dicyclopropylmethyl)-1H-indole-2-carboxamide?
The canonical SMILES for N-(dicyclopropylmethyl)-1H-indole-2-carboxamide is O=C(NC(C1CC1)C1CC1)c1cc2ccccc2[nH]1.
What is the InChIKey of N-(dicyclopropylmethyl)-1H-indole-2-carboxamide?
The InChIKey is WYBKIQDTKKMNRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c19-16(18-15(10-5-6-10)11-7-8-11)14-9-12-3-1-2-4-13(12)17-14/h1-4,9-11,15,17H,5-8H2,(H,18,19).
What are the key properties of N-(dicyclopropylmethyl)-1H-indole-2-carboxamide?
N-(dicyclopropylmethyl)-1H-indole-2-carboxamide has a molecular weight of 254.33 g/mol, XLogP of 3.09, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 47143820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).