(2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide

C14H19N3O — CID 83020881

IUPAC(2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide
SMILESO=C(NN1CCCCC1)[C@@H]1Cc2ccccc2N1
InChIInChI=1S/C14H19N3O/c18-14(16-17-8-4-1-5-9-17)13-10-11-6-2-3-7-12(11)15-13/h2-3,6-7,13,15H,1,4-5,8-10H2,(H,16,18)/t13-/m0/s1
InChIKeyIJLUEVUXODZIHU-ZDUSSCGKSA-N
MW245.33 g/mol
LogP1.54
Rot. Bonds2

About (2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide

(2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 83020881) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is (2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide
PubChem CID83020881
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name(2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide
SMILESO=C(NN1CCCCC1)[C@@H]1Cc2ccccc2N1
InChIInChI=1S/C14H19N3O/c18-14(16-17-8-4-1-5-9-17)13-10-11-6-2-3-7-12(11)15-13/h2-3,6-7,13,15H,1,4-5,8-10H2,(H,16,18)/t13-/m0/s1
InChIKeyIJLUEVUXODZIHU-ZDUSSCGKSA-N
XLogP1.54
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide
CID 83022174
N-hydroxy-2,3-dihydro-1H-indole-2-carboxamide
CID 77014605
[(2S)-2,3-dihydro-1H-indol-2-yl]-pyrrolidin-1-ylmethanone
CID 61148628
(2S)-N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61178008
bis(2,3-dihydro-1H-indol-2-yl)methanone
CID 174436301
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide
CID 107852883
(2S)-N-[(1S,2S)-2-hydroxycyclohexyl]-2,3-dihydro-1H-indole-2-carboxamide
CID 107221687
1-[[(2S)-2,3-dihydro-1H-indole-2-carbonyl]amino]cyclobutane-1-carboxylic acid
CID 81161703
(2S)-N-[(1S)-1-cyclohexylethyl]-2,3-dihydro-1H-indole-2-carboxamide
CID 81385786
N-methylsulfonyl-2,3-dihydro-1H-indole-2-carboxamide
CID 103287754
(2S)-N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2,3-dihydro-1H-indole-2-carboxamide
CID 106188200
(2S)-N-[5-(pyrrolidine-1-carbonyl)thiophen-2-yl]-2,3-dihydro-1H-indole-2-carboxamide
CID 162697980

Frequently Asked Questions

What is the IUPAC name of (2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide?
The IUPAC name of (2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide (CID 83020881) is (2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide.
What is the SMILES notation for (2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide?
The canonical SMILES for (2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide is O=C(NN1CCCCC1)[C@@H]1Cc2ccccc2N1.
What is the InChIKey of (2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide?
The InChIKey is IJLUEVUXODZIHU-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H19N3O/c18-14(16-17-8-4-1-5-9-17)13-10-11-6-2-3-7-12(11)15-13/h2-3,6-7,13,15H,1,4-5,8-10H2,(H,16,18)/t13-/m0/s1.
What are the key properties of (2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide?
(2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 245.33 g/mol, XLogP of 1.54, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-piperidin-1-yl-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 83020881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).