N-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide

C16H21N3O — CID 63628878

IUPACN-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide
SMILESO=C(NCCC1CCCNC1)c1cc2ccccc2[nH]1
InChIInChI=1S/C16H21N3O/c20-16(18-9-7-12-4-3-8-17-11-12)15-10-13-5-1-2-6-14(13)19-15/h1-2,5-6,10,12,17,19H,3-4,7-9,11H2,(H,18,20)
InChIKeyJOMBXDCHJMUYMZ-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.29
Rot. Bonds4

About N-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide

N-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide (PubChem CID 63628878) has the molecular formula C16H21N3O and a molecular weight of 271.36 g/mol. Its IUPAC name is N-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide
PubChem CID63628878
Molecular FormulaC16H21N3O
Molecular Weight271.36 g/mol
Exact Mass271.17
IUPAC NameN-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide
SMILESO=C(NCCC1CCCNC1)c1cc2ccccc2[nH]1
InChIInChI=1S/C16H21N3O/c20-16(18-9-7-12-4-3-8-17-11-12)15-10-13-5-1-2-6-14(13)19-15/h1-2,5-6,10,12,17,19H,3-4,7-9,11H2,(H,18,20)
InChIKeyJOMBXDCHJMUYMZ-UHFFFAOYSA-N
XLogP2.29
TPSA56.92 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

4-iodo-N-(2-piperidin-3-ylethyl)-1H-pyrrole-2-carboxamide
CID 119557742
N-(2-piperidin-3-ylethyl)-1H-indazole-3-carboxamide
CID 63629056
2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119554934
3-chloro-N-(2-piperidin-3-ylethyl)benzamide
CID 63628186
1-N-methyl-3-N-(2-piperidin-3-ylethyl)benzene-1,3-dicarboxamide
CID 119559534
5-amino-N-(2-cyclohexylethyl)-1H-indole-2-carboxamide
CID 62056992
2,3,5,6-tetrafluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119555428
3-iodo-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119555518
N-(2-piperidin-3-ylethyl)-2-(trifluoromethyl)benzamide
CID 60895336
1-phenyl-3-(2-piperidin-3-ylethyl)urea
CID 60895337
4-iodo-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119554925
2-oxo-N-(2-piperidin-3-ylethyl)-1H-pyridine-4-carboxamide
CID 103806761

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide?
The IUPAC name of N-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide (CID 63628878) is N-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide.
What is the SMILES notation for N-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide?
The canonical SMILES for N-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide is O=C(NCCC1CCCNC1)c1cc2ccccc2[nH]1.
What is the InChIKey of N-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide?
The InChIKey is JOMBXDCHJMUYMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O/c20-16(18-9-7-12-4-3-8-17-11-12)15-10-13-5-1-2-6-14(13)19-15/h1-2,5-6,10,12,17,19H,3-4,7-9,11H2,(H,18,20).
What are the key properties of N-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide?
N-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide has a molecular weight of 271.36 g/mol, XLogP of 2.29, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-3-ylethyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 63628878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).