N-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide

C18H27N3O — CID 60576930

IUPACN-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide
SMILESCC1CCCN(CC(C)NC(=O)N2CCc3ccccc32)C1
InChIInChI=1S/C18H27N3O/c1-14-6-5-10-20(12-14)13-15(2)19-18(22)21-11-9-16-7-3-4-8-17(16)21/h3-4,7-8,14-15H,5-6,9-13H2,1-2H3,(H,19,22)
InChIKeyPIXSKKVLBWDXSN-UHFFFAOYSA-N
MW301.43 g/mol
LogP2.88
Rot. Bonds3

About N-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide

N-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide (PubChem CID 60576930) has the molecular formula C18H27N3O and a molecular weight of 301.43 g/mol. Its IUPAC name is N-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide.

Molecular Properties

Compound NameN-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide
PubChem CID60576930
Molecular FormulaC18H27N3O
Molecular Weight301.43 g/mol
Exact Mass301.22
IUPAC NameN-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide
SMILESCC1CCCN(CC(C)NC(=O)N2CCc3ccccc32)C1
InChIInChI=1S/C18H27N3O/c1-14-6-5-10-20(12-14)13-15(2)19-18(22)21-11-9-16-7-3-4-8-17(16)21/h3-4,7-8,14-15H,5-6,9-13H2,1-2H3,(H,19,22)
InChIKeyPIXSKKVLBWDXSN-UHFFFAOYSA-N
XLogP2.88
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.43
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-N-[1-(3-methylpiperidin-1-yl)propan-2-yl]piperidine-1-carboxamide
CID 60577941
2-hydroxy-N-[1-(3-methylpiperidin-1-yl)propan-2-yl]benzamide
CID 47379683
1-(2,3-dihydroindol-1-yl)-2-(3-methylpiperidin-1-yl)ethane-1,2-dione
CID 47335819
2-amino-N-[1-(3-methylpiperidin-1-yl)propan-2-yl]acetamide
CID 119863261
N'-methyl-N-[4-(3-methylpiperidin-1-yl)butyl]-2,3-dihydroindole-1-carboximidamide
CID 110983752
2-methyl-N-[1-(3-methylpiperidin-1-yl)propan-2-yl]piperidine-1-carboxamide
CID 60577595
3-cyclohexyl-2-(2,3-dihydroindole-1-carbonylamino)propanoic acid
CID 166748735
2-(2,3-dihydroindole-1-carbonylamino)-4-hydroxybutanoic acid
CID 61230248
(3R)-N-[(2R)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]-3-(hydroxymethyl)piperidine-1-carboxamide
CID 95597531
N-(cyclohexylmethyl)-2,3-dihydroindole-1-carboxamide
CID 67190094
(2S,3R)-2-(2,3-dihydroindole-1-carbonylamino)-3-methylpentanoic acid
CID 41129473
2-(2-cyanophenyl)sulfanyl-N-[1-(3-methylpiperidin-1-yl)propan-2-yl]benzamide
CID 60576162

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide?
The IUPAC name of N-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide (CID 60576930) is N-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide.
What is the SMILES notation for N-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide?
The canonical SMILES for N-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide is CC1CCCN(CC(C)NC(=O)N2CCc3ccccc32)C1.
What is the InChIKey of N-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide?
The InChIKey is PIXSKKVLBWDXSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O/c1-14-6-5-10-20(12-14)13-15(2)19-18(22)21-11-9-16-7-3-4-8-17(16)21/h3-4,7-8,14-15H,5-6,9-13H2,1-2H3,(H,19,22).
What are the key properties of N-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide?
N-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide has a molecular weight of 301.43 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methylpiperidin-1-yl)propan-2-yl]-2,3-dihydroindole-1-carboxamide is sourced from PubChem (CID 60576930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).