1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide

C16H19N3O2 — CID 63716587

IUPAC1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1C(=O)c1ccc2[nH]ccc2c1
InChIInChI=1S/C16H19N3O2/c1-17-15(20)14-4-2-3-9-19(14)16(21)12-5-6-13-11(10-12)7-8-18-13/h5-8,10,14,18H,2-4,9H2,1H3,(H,17,20)
InChIKeyMXMPQGHRVYIWIZ-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.91
Rot. Bonds2

About 1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide

1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide (PubChem CID 63716587) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide.

Molecular Properties

Compound Name1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide
PubChem CID63716587
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1C(=O)c1ccc2[nH]ccc2c1
InChIInChI=1S/C16H19N3O2/c1-17-15(20)14-4-2-3-9-19(14)16(21)12-5-6-13-11(10-12)7-8-18-13/h5-8,10,14,18H,2-4,9H2,1H3,(H,17,20)
InChIKeyMXMPQGHRVYIWIZ-UHFFFAOYSA-N
XLogP1.91
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide?
The IUPAC name of 1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide (CID 63716587) is 1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide.
What is the SMILES notation for 1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide?
The canonical SMILES for 1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide is CNC(=O)C1CCCCN1C(=O)c1ccc2[nH]ccc2c1.
What is the InChIKey of 1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide?
The InChIKey is MXMPQGHRVYIWIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-17-15(20)14-4-2-3-9-19(14)16(21)12-5-6-13-11(10-12)7-8-18-13/h5-8,10,14,18H,2-4,9H2,1H3,(H,17,20).
What are the key properties of 1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide?
1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 1.91, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indole-5-carbonyl)-N-methylpiperidine-2-carboxamide is sourced from PubChem (CID 63716587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).