6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine

C14H19N5O — CID 144538357

IUPAC6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine
SMILESCc1nc(NCc2cnn(C)c2)cc(OCC2CC2)n1
InChIInChI=1S/C14H19N5O/c1-10-17-13(15-6-12-7-16-19(2)8-12)5-14(18-10)20-9-11-3-4-11/h5,7-8,11H,3-4,6,9H2,1-2H3,(H,15,17,18)
InChIKeyQHINUYJLSVCQLL-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.92
Rot. Bonds6

About 6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine

6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine (PubChem CID 144538357) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine
PubChem CID144538357
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine
SMILESCc1nc(NCc2cnn(C)c2)cc(OCC2CC2)n1
InChIInChI=1S/C14H19N5O/c1-10-17-13(15-6-12-7-16-19(2)8-12)5-14(18-10)20-9-11-3-4-11/h5,7-8,11H,3-4,6,9H2,1-2H3,(H,15,17,18)
InChIKeyQHINUYJLSVCQLL-UHFFFAOYSA-N
XLogP1.92
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine?
The IUPAC name of 6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine (CID 144538357) is 6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine?
The canonical SMILES for 6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine is Cc1nc(NCc2cnn(C)c2)cc(OCC2CC2)n1.
What is the InChIKey of 6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine?
The InChIKey is QHINUYJLSVCQLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-10-17-13(15-6-12-7-16-19(2)8-12)5-14(18-10)20-9-11-3-4-11/h5,7-8,11H,3-4,6,9H2,1-2H3,(H,15,17,18).
What are the key properties of 6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine?
6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine has a molecular weight of 273.34 g/mol, XLogP of 1.92, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylmethoxy)-2-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 144538357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).