3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide

C18H25N3O2 — CID 42865415

IUPAC3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide
SMILESCCNC(=O)N1CC(C(=O)NC2CC2)CC(c2ccccc2)C1
InChIInChI=1S/C18H25N3O2/c1-2-19-18(23)21-11-14(13-6-4-3-5-7-13)10-15(12-21)17(22)20-16-8-9-16/h3-7,14-16H,2,8-12H2,1H3,(H,19,23)(H,20,22)
InChIKeyJPHPRXAOIAVFHK-UHFFFAOYSA-N
MW315.42 g/mol
LogP2.10
Rot. Bonds4

About 3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide

3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide (PubChem CID 42865415) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is 3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide
PubChem CID42865415
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC Name3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide
SMILESCCNC(=O)N1CC(C(=O)NC2CC2)CC(c2ccccc2)C1
InChIInChI=1S/C18H25N3O2/c1-2-19-18(23)21-11-14(13-6-4-3-5-7-13)10-15(12-21)17(22)20-16-8-9-16/h3-7,14-16H,2,8-12H2,1H3,(H,19,23)(H,20,22)
InChIKeyJPHPRXAOIAVFHK-UHFFFAOYSA-N
XLogP2.10
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,3-N-diethyl-5-phenylpiperidine-1,3-dicarboxamide
CID 42865414
(3R,5S)-N-cyclopropyl-1-(4-fluorobenzoyl)-5-phenylpiperidine-3-carboxamide
CID 92994693
1-N-ethyl-5-phenyl-3-N-(pyridin-3-ylmethyl)piperidine-1,3-dicarboxamide
CID 42865475
1-benzoyl-N-ethyl-5-phenylpiperidine-3-carboxamide
CID 46065014
(3R,5S)-1-benzoyl-N-ethyl-5-phenylpiperidine-3-carboxamide
CID 92994765
(3R,5R)-1-N-butyl-5-phenyl-3-N-(2-pyrrolidin-1-ylethyl)piperidine-1,3-dicarboxamide
CID 92995666
3-N-cyclopropyl-1-N-ethyl-4-(2-methylphenyl)pyrrolidine-1,3-dicarboxamide
CID 42828595
(2S,4S)-N-ethyl-2-methyl-4-phenylpyrrolidine-1-carboxamide
CID 101423033
(3S,5S)-N-benzyl-1-(cyclopropanecarbonyl)-5-phenylpiperidine-3-carboxamide
CID 92994782
(3R,5R)-N-benzyl-1-(cyclopropanecarbonyl)-5-phenylpiperidine-3-carboxamide
CID 92994779
(3R,5R)-1-benzoyl-N-cyclopropyl-5-(4-fluoro-3-methylphenyl)piperidine-3-carboxamide
CID 92996658
1-N-benzyl-3-N-(furan-2-ylmethyl)-5-phenylpiperidine-1,3-dicarboxamide
CID 46065319

Frequently Asked Questions

What is the IUPAC name of 3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide?
The IUPAC name of 3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide (CID 42865415) is 3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide.
What is the SMILES notation for 3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide?
The canonical SMILES for 3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide is CCNC(=O)N1CC(C(=O)NC2CC2)CC(c2ccccc2)C1.
What is the InChIKey of 3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide?
The InChIKey is JPHPRXAOIAVFHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-2-19-18(23)21-11-14(13-6-4-3-5-7-13)10-15(12-21)17(22)20-16-8-9-16/h3-7,14-16H,2,8-12H2,1H3,(H,19,23)(H,20,22).
What are the key properties of 3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide?
3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide has a molecular weight of 315.42 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-cyclopropyl-1-N-ethyl-5-phenylpiperidine-1,3-dicarboxamide is sourced from PubChem (CID 42865415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).