N-(cyclobutylmethyl)-1H-indole-6-carboxamide

C14H16N2O — CID 47190926

IUPACN-(cyclobutylmethyl)-1H-indole-6-carboxamide
SMILESO=C(NCC1CCC1)c1ccc2cc[nH]c2c1
InChIInChI=1S/C14H16N2O/c17-14(16-9-10-2-1-3-10)12-5-4-11-6-7-15-13(11)8-12/h4-8,10,15H,1-3,9H2,(H,16,17)
InChIKeyZXOQILYMDSEIKQ-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.70
Rot. Bonds3

About N-(cyclobutylmethyl)-1H-indole-6-carboxamide

N-(cyclobutylmethyl)-1H-indole-6-carboxamide (PubChem CID 47190926) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-1H-indole-6-carboxamide
PubChem CID47190926
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC NameN-(cyclobutylmethyl)-1H-indole-6-carboxamide
SMILESO=C(NCC1CCC1)c1ccc2cc[nH]c2c1
InChIInChI=1S/C14H16N2O/c17-14(16-9-10-2-1-3-10)12-5-4-11-6-7-15-13(11)8-12/h4-8,10,15H,1-3,9H2,(H,16,17)
InChIKeyZXOQILYMDSEIKQ-UHFFFAOYSA-N
XLogP2.70
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-(piperidin-4-ylmethyl)-1H-indole-5-carboxamide
CID 63747736
N-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]-1H-indole-6-carboxamide
CID 77088126
N-(piperidin-3-ylmethyl)-1H-indole-5-carboxamide
CID 55230606
N-(cyclopentylmethyl)-2-oxo-1H-pyridine-4-carboxamide
CID 103762861
N-(2,3,4,5-tetrahydro-1-benzoxepin-4-ylmethyl)-1H-indole-6-carboxamide
CID 74242329
N-(3-ethylcyclohexyl)-1H-indole-6-carboxamide
CID 64743570
N-[[1-[3-(1H-pyrazol-4-yl)propanoyl]piperidin-3-yl]methyl]-1H-indole-6-carboxamide
CID 131937541
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1H-indole-6-carboxamide
CID 104971741
N-cyclohexyl-1H-indole-6-carboxamide
CID 39706974
N-(oxolan-2-ylmethyl)-1H-indole-5-carboxamide
CID 63717299
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1H-indole-6-carboxamide
CID 71896039
N-(morpholin-3-ylmethyl)-1H-indole-6-carboxamide
CID 103548357

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-1H-indole-6-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-1H-indole-6-carboxamide (CID 47190926) is N-(cyclobutylmethyl)-1H-indole-6-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-1H-indole-6-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-1H-indole-6-carboxamide is O=C(NCC1CCC1)c1ccc2cc[nH]c2c1.
What is the InChIKey of N-(cyclobutylmethyl)-1H-indole-6-carboxamide?
The InChIKey is ZXOQILYMDSEIKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c17-14(16-9-10-2-1-3-10)12-5-4-11-6-7-15-13(11)8-12/h4-8,10,15H,1-3,9H2,(H,16,17).
What are the key properties of N-(cyclobutylmethyl)-1H-indole-6-carboxamide?
N-(cyclobutylmethyl)-1H-indole-6-carboxamide has a molecular weight of 228.30 g/mol, XLogP of 2.70, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-1H-indole-6-carboxamide is sourced from PubChem (CID 47190926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).