N-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide

C16H29N3O3S — CID 4050955

IUPACN-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide
SMILESCC1CC(C)CN(S(=O)(=O)N2CCCC(C(=O)NC3CC3)C2)C1
InChIInChI=1S/C16H29N3O3S/c1-12-8-13(2)10-19(9-12)23(21,22)18-7-3-4-14(11-18)16(20)17-15-5-6-15/h12-15H,3-11H2,1-2H3,(H,17,20)
InChIKeyLTOJBZDJYANNAZ-UHFFFAOYSA-N
MW343.49 g/mol
LogP1.20
Rot. Bonds4

About N-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide

N-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide (PubChem CID 4050955) has the molecular formula C16H29N3O3S and a molecular weight of 343.49 g/mol. Its IUPAC name is N-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide
PubChem CID4050955
Molecular FormulaC16H29N3O3S
Molecular Weight343.49 g/mol
Exact Mass343.19
IUPAC NameN-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide
SMILESCC1CC(C)CN(S(=O)(=O)N2CCCC(C(=O)NC3CC3)C2)C1
InChIInChI=1S/C16H29N3O3S/c1-12-8-13(2)10-19(9-12)23(21,22)18-7-3-4-14(11-18)16(20)17-15-5-6-15/h12-15H,3-11H2,1-2H3,(H,17,20)
InChIKeyLTOJBZDJYANNAZ-UHFFFAOYSA-N
XLogP1.20
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.49
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide?
The IUPAC name of N-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide (CID 4050955) is N-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide is CC1CC(C)CN(S(=O)(=O)N2CCCC(C(=O)NC3CC3)C2)C1.
What is the InChIKey of N-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide?
The InChIKey is LTOJBZDJYANNAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O3S/c1-12-8-13(2)10-19(9-12)23(21,22)18-7-3-4-14(11-18)16(20)17-15-5-6-15/h12-15H,3-11H2,1-2H3,(H,17,20).
What are the key properties of N-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide?
N-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide has a molecular weight of 343.49 g/mol, XLogP of 1.20, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide is sourced from PubChem (CID 4050955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).