1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine

C11H15N5 — CID 65197639

IUPAC1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine
SMILESCC(N)Cc1cnc(-c2ccn(C)n2)nc1
InChIInChI=1S/C11H15N5/c1-8(12)5-9-6-13-11(14-7-9)10-3-4-16(2)15-10/h3-4,6-8H,5,12H2,1-2H3
InChIKeyLDHQWLNROWJSKK-UHFFFAOYSA-N
MW217.28 g/mol
LogP0.77
Rot. Bonds3

About 1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine

1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine (PubChem CID 65197639) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine.

Molecular Properties

Compound Name1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine
PubChem CID65197639
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine
SMILESCC(N)Cc1cnc(-c2ccn(C)n2)nc1
InChIInChI=1S/C11H15N5/c1-8(12)5-9-6-13-11(14-7-9)10-3-4-16(2)15-10/h3-4,6-8H,5,12H2,1-2H3
InChIKeyLDHQWLNROWJSKK-UHFFFAOYSA-N
XLogP0.77
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(chloromethyl)-2-(1-methylpyrazol-3-yl)pyrimidine
CID 65198161
N-[[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]methyl]ethanamine
CID 65197584
4-[5-(2-aminopropyl)pyrimidin-2-yl]phenol
CID 136889444
3-[4,6-dimethyl-2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]-2-methylpropan-1-amine
CID 65293903
1-[2-(4-fluoro-3-methylphenyl)pyrimidin-5-yl]propan-2-amine
CID 62757182
1-[2-(2-chlorophenyl)pyrimidin-5-yl]propan-2-amine
CID 62755555
(1R)-1-[4-methyl-2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]ethanol
CID 103431364
1-[3,5-dimethyl-4-[(1-methylpyrazol-3-yl)methoxy]phenyl]propan-2-amine
CID 82878160
1-[2-(2-methylpropoxy)pyrimidin-5-yl]propan-2-amine
CID 83884572
2-methyl-3-[3-(1-methylpyrazol-3-yl)-1,2,4-oxadiazol-5-yl]propan-1-amine
CID 81072184
1-[3-(1-methylpyrazol-3-yl)-1H-1,2,4-triazol-5-yl]ethanamine
CID 65198061
6-(1-methylpyrazol-3-yl)-5-propan-2-ylpyrimidin-4-amine
CID 103132081

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine?
The IUPAC name of 1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine (CID 65197639) is 1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine.
What is the SMILES notation for 1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine?
The canonical SMILES for 1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine is CC(N)Cc1cnc(-c2ccn(C)n2)nc1.
What is the InChIKey of 1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine?
The InChIKey is LDHQWLNROWJSKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-8(12)5-9-6-13-11(14-7-9)10-3-4-16(2)15-10/h3-4,6-8H,5,12H2,1-2H3.
What are the key properties of 1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine?
1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine has a molecular weight of 217.28 g/mol, XLogP of 0.77, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-methylpyrazol-3-yl)pyrimidin-5-yl]propan-2-amine is sourced from PubChem (CID 65197639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).