6-cyclohexylsulfanylpyrimidin-4-amine

C10H15N3S — CID 80885379

IUPAC6-cyclohexylsulfanylpyrimidin-4-amine
SMILESNc1cc(SC2CCCCC2)ncn1
InChIInChI=1S/C10H15N3S/c11-9-6-10(13-7-12-9)14-8-4-2-1-3-5-8/h6-8H,1-5H2,(H2,11,12,13)
InChIKeyFMUFYTHGBQUWIU-UHFFFAOYSA-N
MW209.32 g/mol
LogP2.48
Rot. Bonds2

About 6-cyclohexylsulfanylpyrimidin-4-amine

6-cyclohexylsulfanylpyrimidin-4-amine (PubChem CID 80885379) has the molecular formula C10H15N3S and a molecular weight of 209.32 g/mol. Its IUPAC name is 6-cyclohexylsulfanylpyrimidin-4-amine.

Molecular Properties

Compound Name6-cyclohexylsulfanylpyrimidin-4-amine
PubChem CID80885379
Molecular FormulaC10H15N3S
Molecular Weight209.32 g/mol
Exact Mass209.10
IUPAC Name6-cyclohexylsulfanylpyrimidin-4-amine
SMILESNc1cc(SC2CCCCC2)ncn1
InChIInChI=1S/C10H15N3S/c11-9-6-10(13-7-12-9)14-8-4-2-1-3-5-8/h6-8H,1-5H2,(H2,11,12,13)
InChIKeyFMUFYTHGBQUWIU-UHFFFAOYSA-N
XLogP2.48
TPSA51.80 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 ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-cyclohexylsulfanyl-4-pyridinyl)methanamine
CID 60887048
(4-cyclohexylsulfanylpyrimidin-2-yl)hydrazine
CID 80922698
6-cyclopentylsulfanyl-2-propylpyrimidin-4-amine
CID 80946943
4-cyclohexylsulfanyl-6-methyl-7H-pyrrolo[2,3-d]pyrimidine
CID 110430245
6-cyclopentylsulfanyl-4-N-methylpyrimidine-2,4-diamine
CID 80888990
3-cyclopentylsulfanylisoquinoline
CID 132603218
6-N-cycloheptyl-4-N-cyclopentylpyrimidine-4,5,6-triamine
CID 19153951
6-(1-cyclopentyltetrazol-5-yl)sulfanylpyrimidin-4-amine
CID 80882455
(6-cyclohexylsulfanylpyridazin-3-yl)hydrazine
CID 53353135
2,6-bis(cyclohexylsulfanyl)pyridine-4-carbothioamide
CID 10832752
6-(oxolan-2-ylmethylsulfanyl)pyrimidin-4-amine
CID 106497698
1-(6-cyclohexylsulfanyl-5-methyl-3-pyridinyl)ethanamine
CID 102545029

Frequently Asked Questions

What is the IUPAC name of 6-cyclohexylsulfanylpyrimidin-4-amine?
The IUPAC name of 6-cyclohexylsulfanylpyrimidin-4-amine (CID 80885379) is 6-cyclohexylsulfanylpyrimidin-4-amine.
What is the SMILES notation for 6-cyclohexylsulfanylpyrimidin-4-amine?
The canonical SMILES for 6-cyclohexylsulfanylpyrimidin-4-amine is Nc1cc(SC2CCCCC2)ncn1.
What is the InChIKey of 6-cyclohexylsulfanylpyrimidin-4-amine?
The InChIKey is FMUFYTHGBQUWIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3S/c11-9-6-10(13-7-12-9)14-8-4-2-1-3-5-8/h6-8H,1-5H2,(H2,11,12,13).
What are the key properties of 6-cyclohexylsulfanylpyrimidin-4-amine?
6-cyclohexylsulfanylpyrimidin-4-amine has a molecular weight of 209.32 g/mol, XLogP of 2.48, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexylsulfanylpyrimidin-4-amine is sourced from PubChem (CID 80885379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).