N-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide

C15H17N3O2 — CID 6713907

IUPACN-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide
SMILESO=C(N[C@@H]1CCCCNC1=O)c1ccc2cc[nH]c2c1
InChIInChI=1S/C15H17N3O2/c19-14(18-12-3-1-2-7-17-15(12)20)11-5-4-10-6-8-16-13(10)9-11/h4-6,8-9,12,16H,1-3,7H2,(H,17,20)(H,18,19)/t12-/m1/s1
InChIKeyPYLISFYENJFSQG-GFCCVEGCSA-N
MW271.32 g/mol
LogP1.57
Rot. Bonds2

About N-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide

N-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide (PubChem CID 6713907) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide.

Molecular Properties

Compound NameN-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide
PubChem CID6713907
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide
SMILESO=C(N[C@@H]1CCCCNC1=O)c1ccc2cc[nH]c2c1
InChIInChI=1S/C15H17N3O2/c19-14(18-12-3-1-2-7-17-15(12)20)11-5-4-10-6-8-16-13(10)9-11/h4-6,8-9,12,16H,1-3,7H2,(H,17,20)(H,18,19)/t12-/m1/s1
InChIKeyPYLISFYENJFSQG-GFCCVEGCSA-N
XLogP1.57
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-1H-indole-6-carboxamide
CID 39706974
N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1H-indole-6-carboxamide
CID 39705283
3-methoxy-N-(2-oxoazepan-3-yl)benzamide
CID 15069514
2-(1H-indole-6-carbonylamino)cyclohexane-1-carboxylic acid
CID 22712391
4-(bromomethyl)-N-(2-oxoazepan-3-yl)benzamide
CID 102851110
4-[[(3S)-2-oxopiperidin-3-yl]carbamoyl]benzoic acid
CID 94349391
N-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)-1H-indole-6-carboxamide
CID 63770554
4-chloro-N-(2-oxopiperidin-3-yl)benzamide
CID 3531239
2-(aminomethyl)-N-(2-oxoazepan-3-yl)pyridine-4-carboxamide
CID 114325785
3-(3-hydroxy-3-methylbut-1-ynyl)-N-(2-oxoazepan-3-yl)benzamide
CID 50950773
4-chloro-3-iodo-N-(2-oxopiperidin-3-yl)benzamide
CID 47478589
N-(azetidin-3-yl)-1H-indole-6-carboxamide
CID 66186513

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide?
The IUPAC name of N-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide (CID 6713907) is N-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide.
What is the SMILES notation for N-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide?
The canonical SMILES for N-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide is O=C(N[C@@H]1CCCCNC1=O)c1ccc2cc[nH]c2c1.
What is the InChIKey of N-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide?
The InChIKey is PYLISFYENJFSQG-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H17N3O2/c19-14(18-12-3-1-2-7-17-15(12)20)11-5-4-10-6-8-16-13(10)9-11/h4-6,8-9,12,16H,1-3,7H2,(H,17,20)(H,18,19)/t12-/m1/s1.
What are the key properties of N-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide?
N-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 1.57, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-2-oxoazepan-3-yl]-1H-indole-6-carboxamide is sourced from PubChem (CID 6713907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).