4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine

C10H15N3S — CID 131114290

IUPAC4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine
SMILESCc1ccnc(NC2CCSC2C)n1
InChIInChI=1S/C10H15N3S/c1-7-3-5-11-10(12-7)13-9-4-6-14-8(9)2/h3,5,8-9H,4,6H2,1-2H3,(H,11,12,13)
InChIKeyPZIJOGPHQQOWSE-UHFFFAOYSA-N
MW209.32 g/mol
LogP2.09
Rot. Bonds2

About 4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine

4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine (PubChem CID 131114290) has the molecular formula C10H15N3S and a molecular weight of 209.32 g/mol. Its IUPAC name is 4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine
PubChem CID131114290
Molecular FormulaC10H15N3S
Molecular Weight209.32 g/mol
Exact Mass209.10
IUPAC Name4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine
SMILESCc1ccnc(NC2CCSC2C)n1
InChIInChI=1S/C10H15N3S/c1-7-3-5-11-10(12-7)13-9-4-6-14-8(9)2/h3,5,8-9H,4,6H2,1-2H3,(H,11,12,13)
InChIKeyPZIJOGPHQQOWSE-UHFFFAOYSA-N
XLogP2.09
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.32
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-(2-phenylcyclopropyl)pyrimidin-2-amine
CID 62958917
4-methyl-N-(2-methylsulfanylcyclopentyl)pyrimidin-2-amine
CID 103703993
4-N-(2-methylthiolan-3-yl)pyridine-2,4-diamine
CID 131049252
N-(4-methylpyrimidin-2-yl)-1-azabicyclo[2.2.2]octan-3-amine
CID 62959807
4-methyl-N-piperidin-4-ylpyrimidin-2-amine
CID 59744254
N-[(3aR,4R,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1-benzofuran-4-yl]-4-methylpyrimidin-2-amine
CID 97226307
N-(2-ethylsulfanylcyclopentyl)-4-methylpyrimidin-2-amine
CID 103725083
6-chloro-2-methyl-N-(2-methylthiolan-3-yl)pyridin-3-amine
CID 107272240
6-fluoro-N-(2-methylthiolan-3-yl)pyridin-3-amine
CID 102672913
(1R,2R)-2-N-(4-methylpyrimidin-2-yl)-2,3-dihydro-1H-indene-1,2-diamine
CID 138027257
N-(3-methoxycyclopentyl)-4-methylpyrimidin-2-amine
CID 103081989
2-methyl-N-(3-methylphenyl)thiolan-3-amine
CID 102671005

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine?
The IUPAC name of 4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine (CID 131114290) is 4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine?
The canonical SMILES for 4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine is Cc1ccnc(NC2CCSC2C)n1.
What is the InChIKey of 4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine?
The InChIKey is PZIJOGPHQQOWSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3S/c1-7-3-5-11-10(12-7)13-9-4-6-14-8(9)2/h3,5,8-9H,4,6H2,1-2H3,(H,11,12,13).
What are the key properties of 4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine?
4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine has a molecular weight of 209.32 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-methylthiolan-3-yl)pyrimidin-2-amine is sourced from PubChem (CID 131114290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).