N,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide

C15H23N3OS — CID 81236205

IUPACN,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide
SMILESCCCNc1cc(C)ncc1C(=O)N(C)C1CCSC1
InChIInChI=1S/C15H23N3OS/c1-4-6-16-14-8-11(2)17-9-13(14)15(19)18(3)12-5-7-20-10-12/h8-9,12H,4-7,10H2,1-3H3,(H,16,17)
InChIKeyPKORJTSZRWXBGP-UHFFFAOYSA-N
MW293.44 g/mol
LogP2.79
Rot. Bonds5

About N,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide

N,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide (PubChem CID 81236205) has the molecular formula C15H23N3OS and a molecular weight of 293.44 g/mol. Its IUPAC name is N,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide
PubChem CID81236205
Molecular FormulaC15H23N3OS
Molecular Weight293.44 g/mol
Exact Mass293.16
IUPAC NameN,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide
SMILESCCCNc1cc(C)ncc1C(=O)N(C)C1CCSC1
InChIInChI=1S/C15H23N3OS/c1-4-6-16-14-8-11(2)17-9-13(14)15(19)18(3)12-5-7-20-10-12/h8-9,12H,4-7,10H2,1-3H3,(H,16,17)
InChIKeyPKORJTSZRWXBGP-UHFFFAOYSA-N
XLogP2.79
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.44
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-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

Related Compounds

4-(ethylamino)-N,6-dimethyl-N-(4-methylcyclohexyl)pyridine-3-carboxamide
CID 81237067
N,3-dimethyl-4-(propylamino)-N-(thiolan-3-yl)benzamide
CID 63210524
N-(2,2-dimethylpropyl)-N,6-dimethyl-4-(propylamino)pyridine-3-carboxamide
CID 81240756
N,6-dimethyl-N-pentan-2-yl-4-(propylamino)pyridine-3-carboxamide
CID 81243094
N,6-dimethyl-N-(2-methylpropyl)-4-(propylamino)pyridine-3-carboxamide
CID 81236127
N,6-dimethyl-N-(4-methylpentan-2-yl)-4-(propylamino)pyridine-3-carboxamide
CID 81237786
[6-methyl-4-(propylamino)-3-pyridinyl]-(3-methylpyrrolidin-1-yl)methanone
CID 81242822
N-butyl-6-methyl-4-(propylamino)pyridine-3-carboxamide
CID 81235324
6-methyl-N-[2-oxo-2-(propylamino)ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 81237526
N-(2,2-dimethylcyclopropyl)-6-methyl-4-(propylamino)pyridine-3-carboxamide
CID 81243069
(3-hydroxypyrrolidin-1-yl)-[6-methyl-4-(propylamino)-3-pyridinyl]methanone
CID 81239972
6-methyl-N-[(5-oxopyrrolidin-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide
CID 81234441

Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide?
The IUPAC name of N,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide (CID 81236205) is N,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for N,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide?
The canonical SMILES for N,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide is CCCNc1cc(C)ncc1C(=O)N(C)C1CCSC1.
What is the InChIKey of N,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide?
The InChIKey is PKORJTSZRWXBGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3OS/c1-4-6-16-14-8-11(2)17-9-13(14)15(19)18(3)12-5-7-20-10-12/h8-9,12H,4-7,10H2,1-3H3,(H,16,17).
What are the key properties of N,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide?
N,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide has a molecular weight of 293.44 g/mol, XLogP of 2.79, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-4-(propylamino)-N-(thiolan-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 81236205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).