4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide

C20H29N3O2 — CID 24981652

IUPAC4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide
SMILESCC1CC(C)CN(C(=O)C2CCN(C(=O)Nc3ccccc3)CC2)C1
InChIInChI=1S/C20H29N3O2/c1-15-12-16(2)14-23(13-15)19(24)17-8-10-22(11-9-17)20(25)21-18-6-4-3-5-7-18/h3-7,15-17H,8-14H2,1-2H3,(H,21,25)
InChIKeyGTLYJLJTBMLXCH-UHFFFAOYSA-N
MW343.47 g/mol
LogP3.43
Rot. Bonds2

About 4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide

4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide (PubChem CID 24981652) has the molecular formula C20H29N3O2 and a molecular weight of 343.47 g/mol. Its IUPAC name is 4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide
PubChem CID24981652
Molecular FormulaC20H29N3O2
Molecular Weight343.47 g/mol
Exact Mass343.23
IUPAC Name4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide
SMILESCC1CC(C)CN(C(=O)C2CCN(C(=O)Nc3ccccc3)CC2)C1
InChIInChI=1S/C20H29N3O2/c1-15-12-16(2)14-23(13-15)19(24)17-8-10-22(11-9-17)20(25)21-18-6-4-3-5-7-18/h3-7,15-17H,8-14H2,1-2H3,(H,21,25)
InChIKeyGTLYJLJTBMLXCH-UHFFFAOYSA-N
XLogP3.43
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide?
The IUPAC name of 4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide (CID 24981652) is 4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide.
What is the SMILES notation for 4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide?
The canonical SMILES for 4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide is CC1CC(C)CN(C(=O)C2CCN(C(=O)Nc3ccccc3)CC2)C1.
What is the InChIKey of 4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide?
The InChIKey is GTLYJLJTBMLXCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O2/c1-15-12-16(2)14-23(13-15)19(24)17-8-10-22(11-9-17)20(25)21-18-6-4-3-5-7-18/h3-7,15-17H,8-14H2,1-2H3,(H,21,25).
What are the key properties of 4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide?
4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide has a molecular weight of 343.47 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethylpiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide is sourced from PubChem (CID 24981652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).