N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide

C15H17N3O — CID 43594469

IUPACN-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)NC1C2CNCC21
InChIInChI=1S/C15H17N3O/c19-14(18-15-11-7-16-8-12(11)15)5-9-6-17-13-4-2-1-3-10(9)13/h1-4,6,11-12,15-17H,5,7-8H2,(H,18,19)
InChIKeyDHNYDKNPYQIWKA-UHFFFAOYSA-N
MW255.32 g/mol
LogP1.04
Rot. Bonds3

About N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide

N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide (PubChem CID 43594469) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide
PubChem CID43594469
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)NC1C2CNCC21
InChIInChI=1S/C15H17N3O/c19-14(18-15-11-7-16-8-12(11)15)5-9-6-17-13-4-2-1-3-10(9)13/h1-4,6,11-12,15-17H,5,7-8H2,(H,18,19)
InChIKeyDHNYDKNPYQIWKA-UHFFFAOYSA-N
XLogP1.04
TPSA56.92 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 51.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide
CID 103767102
N-hydroxy-2-(1H-indol-3-yl)acetamide
CID 13058633
N-[2-(cyclopentylamino)-2-oxoethyl]-2-(1H-indol-3-yl)acetamide
CID 112990882
N-cyclopropyl-3-[[2-(1H-indol-3-yl)acetyl]amino]propanamide
CID 79382425
2-(1H-indol-3-yl)-N-(3-methoxycyclobutyl)acetamide
CID 104578428
2-(1H-indol-3-yl)-N-[(2-methylcyclopentyl)methyl]acetamide
CID 107420241
N-[(2S)-2-hydroxypropyl]-2-(1H-indol-3-yl)acetamide
CID 39248120
N-[(2-fluorophenyl)methyl]-2-(1H-indol-3-yl)acetamide
CID 3562962
N-cyclopentyloxy-2-(1H-indol-3-yl)acetamide
CID 83202752
N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide
CID 60704601
N-(3,4-dimethylcyclohexyl)-2-(1H-indol-3-yl)acetamide
CID 64742201
N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide
CID 29437842

Frequently Asked Questions

What is the IUPAC name of N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide?
The IUPAC name of N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide (CID 43594469) is N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide.
What is the SMILES notation for N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide?
The canonical SMILES for N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide is O=C(Cc1c[nH]c2ccccc12)NC1C2CNCC21.
What is the InChIKey of N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide?
The InChIKey is DHNYDKNPYQIWKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c19-14(18-15-11-7-16-8-12(11)15)5-9-6-17-13-4-2-1-3-10(9)13/h1-4,6,11-12,15-17H,5,7-8H2,(H,18,19).
What are the key properties of N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide?
N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide has a molecular weight of 255.32 g/mol, XLogP of 1.04, 3 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)-2-(1H-indol-3-yl)acetamide is sourced from PubChem (CID 43594469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).