N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine

C9H10N6 — CID 155941701

IUPACN-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine
SMILESc1nc(NC2CC2)cc(-n2cncn2)n1
InChIInChI=1S/C9H10N6/c1-2-7(1)14-8-3-9(12-5-11-8)15-6-10-4-13-15/h3-7H,1-2H2,(H,11,12,14)
InChIKeyJPSUZWCRGOCNQG-UHFFFAOYSA-N
MW202.22 g/mol
LogP0.63
Rot. Bonds3

About N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine

N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine (PubChem CID 155941701) has the molecular formula C9H10N6 and a molecular weight of 202.22 g/mol. Its IUPAC name is N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine
PubChem CID155941701
Molecular FormulaC9H10N6
Molecular Weight202.22 g/mol
Exact Mass202.10
IUPAC NameN-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine
SMILESc1nc(NC2CC2)cc(-n2cncn2)n1
InChIInChI=1S/C9H10N6/c1-2-7(1)14-8-3-9(12-5-11-8)15-6-10-4-13-15/h3-7H,1-2H2,(H,11,12,14)
InChIKeyJPSUZWCRGOCNQG-UHFFFAOYSA-N
XLogP0.63
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-cyclohexyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine
CID 155941768
(1S)-N-[6-(1,2,4-triazol-1-yl)pyrimidin-4-yl]cyclohex-3-ene-1-carboxamide
CID 97354800
N-cyclopropyl-1-[6-(1,2,4-triazol-1-yl)pyrimidin-4-yl]azetidine-3-carboxamide
CID 121168450
6-N-cyclohexyl-4-N-cyclopropylpyrimidine-4,6-diamine
CID 112854680
4-[6-(1,2,4-triazol-1-yl)pyrimidin-4-yl]oxycyclohexan-1-one
CID 123757404
6-(2-chloroimidazol-1-yl)-N-cyclopropylpyrimidin-4-amine
CID 58973138
N-cyclopropyl-6-pyrimidin-5-ylpyrimidin-4-amine
CID 141185839
1-[6-(cyclopropylamino)pyrimidin-4-yl]piperidin-3-ol
CID 66569760
1-[6-(cyclobutylamino)pyrimidin-4-yl]piperidin-4-ol
CID 115265259
N-[6-(1,2,4-triazol-1-yl)pyrimidin-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 121135441
N-(4-propan-2-ylcyclohexyl)-6-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 62708772
N-[2-(4-fluorophenyl)ethyl]-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine
CID 155942152

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine?
The IUPAC name of N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine (CID 155941701) is N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine.
What is the SMILES notation for N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine?
The canonical SMILES for N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine is c1nc(NC2CC2)cc(-n2cncn2)n1.
What is the InChIKey of N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine?
The InChIKey is JPSUZWCRGOCNQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N6/c1-2-7(1)14-8-3-9(12-5-11-8)15-6-10-4-13-15/h3-7H,1-2H2,(H,11,12,14).
What are the key properties of N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine?
N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine has a molecular weight of 202.22 g/mol, XLogP of 0.63, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 155941701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).