N-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide

C16H23N3O — CID 61169040

IUPACN-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide
SMILESCCN1CCCC(NC(=O)c2ccc3c(c2)CCN3)C1
InChIInChI=1S/C16H23N3O/c1-2-19-9-3-4-14(11-19)18-16(20)13-5-6-15-12(10-13)7-8-17-15/h5-6,10,14,17H,2-4,7-9,11H2,1H3,(H,18,20)
InChIKeyATUYIBFUBKDOJO-UHFFFAOYSA-N
MW273.38 g/mol
LogP1.87
Rot. Bonds3

About N-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide

N-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide (PubChem CID 61169040) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is N-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide.

Molecular Properties

Compound NameN-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide
PubChem CID61169040
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC NameN-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide
SMILESCCN1CCCC(NC(=O)c2ccc3c(c2)CCN3)C1
InChIInChI=1S/C16H23N3O/c1-2-19-9-3-4-14(11-19)18-16(20)13-5-6-15-12(10-13)7-8-17-15/h5-6,10,14,17H,2-4,7-9,11H2,1H3,(H,18,20)
InChIKeyATUYIBFUBKDOJO-UHFFFAOYSA-N
XLogP1.87
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide?
The IUPAC name of N-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide (CID 61169040) is N-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide.
What is the SMILES notation for N-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide?
The canonical SMILES for N-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide is CCN1CCCC(NC(=O)c2ccc3c(c2)CCN3)C1.
What is the InChIKey of N-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide?
The InChIKey is ATUYIBFUBKDOJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c1-2-19-9-3-4-14(11-19)18-16(20)13-5-6-15-12(10-13)7-8-17-15/h5-6,10,14,17H,2-4,7-9,11H2,1H3,(H,18,20).
What are the key properties of N-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide?
N-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide has a molecular weight of 273.38 g/mol, XLogP of 1.87, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-3-yl)-2,3-dihydro-1H-indole-5-carboxamide is sourced from PubChem (CID 61169040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).