(2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide

C10H14N2OS — CID 124505183

IUPAC(2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide
SMILESCS[C@H](C)C(=O)N(C)c1cccnc1
InChIInChI=1S/C10H14N2OS/c1-8(14-3)10(13)12(2)9-5-4-6-11-7-9/h4-8H,1-3H3/t8-/m1/s1
InChIKeyAURGPNWOPBFARN-MRVPVSSYSA-N
MW210.30 g/mol
LogP1.80
Rot. Bonds3

About (2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide

(2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide (PubChem CID 124505183) has the molecular formula C10H14N2OS and a molecular weight of 210.30 g/mol. Its IUPAC name is (2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide.

Molecular Properties

Compound Name(2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide
PubChem CID124505183
Molecular FormulaC10H14N2OS
Molecular Weight210.30 g/mol
Exact Mass210.08
IUPAC Name(2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide
SMILESCS[C@H](C)C(=O)N(C)c1cccnc1
InChIInChI=1S/C10H14N2OS/c1-8(14-3)10(13)12(2)9-5-4-6-11-7-9/h4-8H,1-3H3/t8-/m1/s1
InChIKeyAURGPNWOPBFARN-MRVPVSSYSA-N
XLogP1.80
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(hydroxymethyl)-N,3-dimethyl-N-pyridin-3-ylbutanamide
CID 115187257
N-methyl-N-pyridin-3-ylcarbamoyl chloride
CID 115194564
6-amino-N,2-dimethyl-N-pyridin-3-ylheptanamide
CID 65291290
2-amino-3-methoxy-N-methyl-N-pyridin-3-ylpropanamide
CID 81088465
methyl N,N'-dimethyl-N-pyridin-3-ylcarbamimidothioate
CID 45116234
formaldehyde;1-methyl-1-pyridin-3-ylhydrazine
CID 143631457
5-amino-N-methyl-N-pyridin-3-ylhexanamide
CID 82852147
(2S)-N-methyl-2-methylsulfanyl-N-(pyridin-4-ylmethyl)propanamide
CID 94155976
[2-[methyl(pyridin-3-yl)amino]-2-oxoethyl]carbamic acid
CID 174507293
3,3-dimethyl-4-[methyl(pyridin-3-yl)amino]-4-oxobutanoic acid
CID 115164800
4-acetamido-N-methyl-N-pyridin-3-ylbenzamide
CID 59607027
2,2-difluoro-N,3-dimethyl-N-pyridin-3-ylcyclopropane-1-carboxamide
CID 126766987

Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide?
The IUPAC name of (2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide (CID 124505183) is (2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide.
What is the SMILES notation for (2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide?
The canonical SMILES for (2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide is CS[C@H](C)C(=O)N(C)c1cccnc1.
What is the InChIKey of (2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide?
The InChIKey is AURGPNWOPBFARN-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H14N2OS/c1-8(14-3)10(13)12(2)9-5-4-6-11-7-9/h4-8H,1-3H3/t8-/m1/s1.
What are the key properties of (2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide?
(2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide has a molecular weight of 210.30 g/mol, XLogP of 1.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methyl-2-methylsulfanyl-N-pyridin-3-ylpropanamide is sourced from PubChem (CID 124505183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).