3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine

C12H19N3S — CID 106325916

IUPAC3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine
SMILESCc1cccnc1NCCN1CCSCC1
InChIInChI=1S/C12H19N3S/c1-11-3-2-4-13-12(11)14-5-6-15-7-9-16-10-8-15/h2-4H,5-10H2,1H3,(H,13,14)
InChIKeyDLDUDHWOAJOEBS-UHFFFAOYSA-N
MW237.37 g/mol
LogP1.85
Rot. Bonds4

About 3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine

3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine (PubChem CID 106325916) has the molecular formula C12H19N3S and a molecular weight of 237.37 g/mol. Its IUPAC name is 3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine.

Molecular Properties

Compound Name3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine
PubChem CID106325916
Molecular FormulaC12H19N3S
Molecular Weight237.37 g/mol
Exact Mass237.13
IUPAC Name3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine
SMILESCc1cccnc1NCCN1CCSCC1
InChIInChI=1S/C12H19N3S/c1-11-3-2-4-13-12(11)14-5-6-15-7-9-16-10-8-15/h2-4H,5-10H2,1H3,(H,13,14)
InChIKeyDLDUDHWOAJOEBS-UHFFFAOYSA-N
XLogP1.85
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.37
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-thiomorpholin-4-ylethylamino)pyridine-3-carboxamide
CID 113234725
N-(2-thiomorpholin-4-ylethyl)pyrazolo[1,5-a]pyrazin-4-amine
CID 106325932
2-methyl-N-(2-thiomorpholin-4-ylethyl)benzenesulfonamide
CID 113248054
2-N-ethyl-5-methyl-4-N-(2-thiomorpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 106327612
2-N-methyl-4-N-(2-thiomorpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 114174041
3-amino-2-(2-thiomorpholin-4-ylethylamino)pyridine-4-carbonitrile
CID 114173737
N-[2-(azepan-1-yl)ethyl]-3-chloropyridin-2-amine
CID 61241551
3-bromo-4-methyl-2-N-(2-thiomorpholin-4-ylethyl)pyridine-2,5-diamine
CID 114173719
N'-(3-methyl-2-pyridinyl)hexane-1,6-diamine
CID 107844649
5-chloro-2-N-methyl-4-N-(2-thiomorpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 106327571
3-methylsulfonyl-N-(2-pyrrolidin-1-ylethyl)pyridin-2-amine
CID 114598848
3-methyl-N-(3-methylbutyl)pyridin-2-amine
CID 60960877

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine?
The IUPAC name of 3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine (CID 106325916) is 3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine.
What is the SMILES notation for 3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine?
The canonical SMILES for 3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine is Cc1cccnc1NCCN1CCSCC1.
What is the InChIKey of 3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine?
The InChIKey is DLDUDHWOAJOEBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3S/c1-11-3-2-4-13-12(11)14-5-6-15-7-9-16-10-8-15/h2-4H,5-10H2,1H3,(H,13,14).
What are the key properties of 3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine?
3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine has a molecular weight of 237.37 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-thiomorpholin-4-ylethyl)pyridin-2-amine is sourced from PubChem (CID 106325916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).