N-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide

C19H24N4O3S — CID 154763206

IUPACN-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide
SMILESO=C(NCCS(=O)(=O)C1CC1)N1CCC(c2ccc3cccnc3n2)CC1
InChIInChI=1S/C19H24N4O3S/c24-19(21-10-13-27(25,26)16-4-5-16)23-11-7-14(8-12-23)17-6-3-15-2-1-9-20-18(15)22-17/h1-3,6,9,14,16H,4-5,7-8,10-13H2,(H,21,24)
InChIKeyBQLLXXNOPIARJG-UHFFFAOYSA-N
MW388.49 g/mol
LogP2.10
Rot. Bonds5

About N-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide

N-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide (PubChem CID 154763206) has the molecular formula C19H24N4O3S and a molecular weight of 388.49 g/mol. Its IUPAC name is N-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide
PubChem CID154763206
Molecular FormulaC19H24N4O3S
Molecular Weight388.49 g/mol
Exact Mass388.16
IUPAC NameN-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide
SMILESO=C(NCCS(=O)(=O)C1CC1)N1CCC(c2ccc3cccnc3n2)CC1
InChIInChI=1S/C19H24N4O3S/c24-19(21-10-13-27(25,26)16-4-5-16)23-11-7-14(8-12-23)17-6-3-15-2-1-9-20-18(15)22-17/h1-3,6,9,14,16H,4-5,7-8,10-13H2,(H,21,24)
InChIKeyBQLLXXNOPIARJG-UHFFFAOYSA-N
XLogP2.10
TPSA92.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-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

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide?
The IUPAC name of N-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide (CID 154763206) is N-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide?
The canonical SMILES for N-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide is O=C(NCCS(=O)(=O)C1CC1)N1CCC(c2ccc3cccnc3n2)CC1.
What is the InChIKey of N-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide?
The InChIKey is BQLLXXNOPIARJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3S/c24-19(21-10-13-27(25,26)16-4-5-16)23-11-7-14(8-12-23)17-6-3-15-2-1-9-20-18(15)22-17/h1-3,6,9,14,16H,4-5,7-8,10-13H2,(H,21,24).
What are the key properties of N-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide?
N-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide has a molecular weight of 388.49 g/mol, XLogP of 2.10, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylsulfonylethyl)-4-(1,8-naphthyridin-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 154763206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).