N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide

C14H15N3O — CID 43594493

IUPACN-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide
SMILESO=C(NC1C2CNCC21)c1cccc2[nH]ccc12
InChIInChI=1S/C14H15N3O/c18-14(17-13-10-6-15-7-11(10)13)9-2-1-3-12-8(9)4-5-16-12/h1-5,10-11,13,15-16H,6-7H2,(H,17,18)
InChIKeyNENUASRKLSTLFV-UHFFFAOYSA-N
MW241.29 g/mol
LogP1.12
Rot. Bonds2

About N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide

N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide (PubChem CID 43594493) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide
PubChem CID43594493
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC NameN-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide
SMILESO=C(NC1C2CNCC21)c1cccc2[nH]ccc12
InChIInChI=1S/C14H15N3O/c18-14(17-13-10-6-15-7-11(10)13)9-2-1-3-12-8(9)4-5-16-12/h1-5,10-11,13,15-16H,6-7H2,(H,17,18)
InChIKeyNENUASRKLSTLFV-UHFFFAOYSA-N
XLogP1.12
TPSA56.92 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 51.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-1H-indole-4-carboxamide
CID 43582325
N-piperidin-3-yl-1H-indole-4-carboxamide
CID 63321491
N-[(3R)-piperidin-3-yl]-1H-indole-4-carboxamide
CID 104645556
N-(2-ethylcyclopropyl)-1H-indole-4-carboxamide
CID 103721300
N-(2-hydroxycyclohexyl)-1H-indole-4-carboxamide
CID 62366462
N-(azepan-4-yl)-1H-indole-4-carboxamide
CID 107172324
1H-indole-4-carbohydrazide
CID 43316644
N-(2-aminocycloheptyl)-1H-indole-4-carboxamide
CID 63257895
N-(4-carbamoylcyclohexyl)-1H-indole-4-carboxamide
CID 61043628
N-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]-1H-indole-4-carboxamide
CID 20872294
N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-hydroxy-3-methylbenzamide
CID 43594388
N-[(2-methylcyclopentyl)methyl]-1H-indole-4-carboxamide
CID 107420261

Frequently Asked Questions

What is the IUPAC name of N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide?
The IUPAC name of N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide (CID 43594493) is N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide.
What is the SMILES notation for N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide?
The canonical SMILES for N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide is O=C(NC1C2CNCC21)c1cccc2[nH]ccc12.
What is the InChIKey of N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide?
The InChIKey is NENUASRKLSTLFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c18-14(17-13-10-6-15-7-11(10)13)9-2-1-3-12-8(9)4-5-16-12/h1-5,10-11,13,15-16H,6-7H2,(H,17,18).
What are the key properties of N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide?
N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide has a molecular weight of 241.29 g/mol, XLogP of 1.12, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-azabicyclo[3.1.0]hexan-6-yl)-1H-indole-4-carboxamide is sourced from PubChem (CID 43594493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).