2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide

C15H23N3OS — CID 97321389

IUPAC2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)N(C)[C@@H]2CCC[C@H]2SC)ccn1
InChIInChI=1S/C15H23N3OS/c1-4-16-14-10-11(8-9-17-14)15(19)18(2)12-6-5-7-13(12)20-3/h8-10,12-13H,4-7H2,1-3H3,(H,16,17)/t12-,13-/m1/s1
InChIKeyKLFGBCDMVHIROK-CHWSQXEVSA-N
MW293.44 g/mol
LogP2.87
Rot. Bonds5

About 2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide

2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide (PubChem CID 97321389) has the molecular formula C15H23N3OS and a molecular weight of 293.44 g/mol. Its IUPAC name is 2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide
PubChem CID97321389
Molecular FormulaC15H23N3OS
Molecular Weight293.44 g/mol
Exact Mass293.16
IUPAC Name2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide
SMILESCCNc1cc(C(=O)N(C)[C@@H]2CCC[C@H]2SC)ccn1
InChIInChI=1S/C15H23N3OS/c1-4-16-14-10-11(8-9-17-14)15(19)18(2)12-6-5-7-13(12)20-3/h8-10,12-13H,4-7H2,1-3H3,(H,16,17)/t12-,13-/m1/s1
InChIKeyKLFGBCDMVHIROK-CHWSQXEVSA-N
XLogP2.87
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 ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-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

6-(Cyclopentylamino)pyridine-3-Carboxamide
CID 112722808
NEP inhibitor, 6r
CID 57340118
N-(4-methylpyridin-2-yl)thiophene-2-carboxamide
CID 685128
[Phosphono-[[4-(propan-2-ylcarbamoyl)-2-pyridinyl]amino]methyl]phosphonic acid
CID 70682771
N-(5-methyl-4-oxo-4,5-dihydro-1,3-thiazol-2-yl)isonicotinamide
CID 135433287
US10343992, Example 28
CID 122590409
[2-(Dimethylamino)pyridin-4-yl]-piperidin-1-ylmethanone
CID 45815721
N,N-dimethyl-2-((propan-2-yl)amino)pyridine-3-carboxamide
CID 84584264
(2-Aminopyridin-4-yl)(pyrrolidin-1-yl)methanone
CID 25219133
2-amino-N,N-dimethylpyridine-4-carboxamide
CID 62154659
N-(4,5-dihydro-1,3-thiazol-2-yl)pyridine-4-carboxamide
CID 2110722
2-(4-oxo-3-prop-2-enylpyrido[2,3-d]pyrimidin-2-yl)sulfanyl-N-propylacetamide
CID 38835882

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide?
The IUPAC name of 2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide (CID 97321389) is 2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide?
The canonical SMILES for 2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide is CCNc1cc(C(=O)N(C)[C@@H]2CCC[C@H]2SC)ccn1.
What is the InChIKey of 2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide?
The InChIKey is KLFGBCDMVHIROK-CHWSQXEVSA-N. The full InChI is InChI=1S/C15H23N3OS/c1-4-16-14-10-11(8-9-17-14)15(19)18(2)12-6-5-7-13(12)20-3/h8-10,12-13H,4-7H2,1-3H3,(H,16,17)/t12-,13-/m1/s1.
What are the key properties of 2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide?
2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide has a molecular weight of 293.44 g/mol, XLogP of 2.87, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-methyl-N-[(1R,2R)-2-methylsulfanylcyclopentyl]pyridine-4-carboxamide is sourced from PubChem (CID 97321389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).