N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide

C16H20N2O — CID 103741634

IUPACN-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide
SMILESCCC1(CNC(=O)c2cccc3[nH]ccc23)CCC1
InChIInChI=1S/C16H20N2O/c1-2-16(8-4-9-16)11-18-15(19)13-5-3-6-14-12(13)7-10-17-14/h3,5-7,10,17H,2,4,8-9,11H2,1H3,(H,18,19)
InChIKeyAQYHYAKTBBKOHQ-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.48
Rot. Bonds4

About N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide

N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide (PubChem CID 103741634) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide
PubChem CID103741634
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC NameN-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide
SMILESCCC1(CNC(=O)c2cccc3[nH]ccc23)CCC1
InChIInChI=1S/C16H20N2O/c1-2-16(8-4-9-16)11-18-15(19)13-5-3-6-14-12(13)7-10-17-14/h3,5-7,10,17H,2,4,8-9,11H2,1H3,(H,18,19)
InChIKeyAQYHYAKTBBKOHQ-UHFFFAOYSA-N
XLogP3.48
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1-ethylcyclopentyl)methyl]-1H-indole-3-carboxamide
CID 103766558
N-[(1-ethylcyclobutyl)methyl]-1-(1H-indol-4-yl)methanamine
CID 113252690
2-amino-N-[(1-ethylcyclobutyl)methyl]benzamide
CID 103822063
N-[1-(hydroxymethyl)cyclobutyl]-1H-indole-4-carboxamide
CID 115878331
3-amino-2-chloro-N-[(1-ethylcyclobutyl)methyl]benzamide
CID 114107092
N-(3-ethyl-2-hydroxypentyl)-1H-indole-4-carboxamide
CID 103723441
N-(2-aminobutyl)-1H-indole-4-carboxamide
CID 63733452
N-[(1-ethylcyclopentyl)methyl]-2-iodo-3-methylbenzamide
CID 103766399
N-[(1-ethylcyclopropyl)methyl]-2,3-dihydroxybenzamide
CID 104931813
N-(2-hydroxypropyl)-1H-indole-4-carboxamide
CID 43501200
N-(2-amino-2-ethylbutyl)-1H-indole-4-carboxamide
CID 115305746
1H-indole-4-carbohydrazide
CID 43316644

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide?
The IUPAC name of N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide (CID 103741634) is N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide.
What is the SMILES notation for N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide?
The canonical SMILES for N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide is CCC1(CNC(=O)c2cccc3[nH]ccc23)CCC1.
What is the InChIKey of N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide?
The InChIKey is AQYHYAKTBBKOHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-2-16(8-4-9-16)11-18-15(19)13-5-3-6-14-12(13)7-10-17-14/h3,5-7,10,17H,2,4,8-9,11H2,1H3,(H,18,19).
What are the key properties of N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide?
N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide has a molecular weight of 256.35 g/mol, XLogP of 3.48, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylcyclobutyl)methyl]-1H-indole-4-carboxamide is sourced from PubChem (CID 103741634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).