(3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide

C17H23N3O — CID 42551679

IUPAC(3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide
SMILESC[C@@H]1C[C@H](C)CN(C(=O)Nc2cn(C)c3ccccc23)C1
InChIInChI=1S/C17H23N3O/c1-12-8-13(2)10-20(9-12)17(21)18-15-11-19(3)16-7-5-4-6-14(15)16/h4-7,11-13H,8-10H2,1-3H3,(H,18,21)/t12-,13+
InChIKeyBSJVRBBCSGAOQB-BETUJISGSA-N
MW285.39 g/mol
LogP3.69
Rot. Bonds1

About (3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide

(3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide (PubChem CID 42551679) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is (3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name(3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide
PubChem CID42551679
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name(3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide
SMILESC[C@@H]1C[C@H](C)CN(C(=O)Nc2cn(C)c3ccccc23)C1
InChIInChI=1S/C17H23N3O/c1-12-8-13(2)10-20(9-12)17(21)18-15-11-19(3)16-7-5-4-6-14(15)16/h4-7,11-13H,8-10H2,1-3H3,(H,18,21)/t12-,13+
InChIKeyBSJVRBBCSGAOQB-BETUJISGSA-N
XLogP3.69
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3R,5R)-N-(2-chlorophenyl)-3,5-dimethylpiperidine-1-carboxamide
CID 40638803
2-methyl-N-(1-methylindol-3-yl)-2,3-dihydroindole-1-carboxamide
CID 18582333
4-(2-methoxyphenyl)-N-(1-methylindol-3-yl)piperazine-1-carboxamide
CID 16803740
N-(1-ethylindol-3-yl)-2,6-dimethylmorpholine-4-carboxamide
CID 18582367
N-[1-(2-methoxyethyl)indol-3-yl]-4-methylpiperidine-1-carboxamide
CID 18582430
1-methyl-N-[2-(pyrrolidine-1-carbonylamino)phenyl]indole-3-carboxamide
CID 55736422
1-methyl-3-(1-methylindol-3-yl)-1-(1-methylpiperidin-4-yl)urea
CID 16813051
3-amino-N-(2-fluorophenyl)-5-methylpiperidine-1-carboxamide
CID 79994443
1-[(1R,2R)-2-methylcyclohexyl]-3-(1-methylindol-3-yl)urea
CID 40519549
3,5-dimethyl-N-(2,3,4-trifluorophenyl)piperidine-1-carboxamide
CID 108892509
1-(1-benzothiophen-3-ylcarbamoyl)-5-methylpiperidine-3-carboxylic acid
CID 122102767
4-amino-N-(1-methylindol-3-yl)pentanamide
CID 115156554

Frequently Asked Questions

What is the IUPAC name of (3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide?
The IUPAC name of (3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide (CID 42551679) is (3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide.
What is the SMILES notation for (3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide?
The canonical SMILES for (3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide is C[C@@H]1C[C@H](C)CN(C(=O)Nc2cn(C)c3ccccc23)C1.
What is the InChIKey of (3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide?
The InChIKey is BSJVRBBCSGAOQB-BETUJISGSA-N. The full InChI is InChI=1S/C17H23N3O/c1-12-8-13(2)10-20(9-12)17(21)18-15-11-19(3)16-7-5-4-6-14(15)16/h4-7,11-13H,8-10H2,1-3H3,(H,18,21)/t12-,13+.
What are the key properties of (3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide?
(3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide has a molecular weight of 285.39 g/mol, XLogP of 3.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,5S)-3,5-dimethyl-N-(1-methylindol-3-yl)piperidine-1-carboxamide is sourced from PubChem (CID 42551679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).