[4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine

C12H14N4 — CID 62492452

IUPAC[4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine
SMILESNCc1cc(-n2ccc(C3CC3)n2)ccn1
InChIInChI=1S/C12H14N4/c13-8-10-7-11(3-5-14-10)16-6-4-12(15-16)9-1-2-9/h3-7,9H,1-2,8,13H2
InChIKeyQNXQWUHWYTYZJG-UHFFFAOYSA-N
MW214.27 g/mol
LogP1.60
Rot. Bonds3

About [4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine

[4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine (PubChem CID 62492452) has the molecular formula C12H14N4 and a molecular weight of 214.27 g/mol. Its IUPAC name is [4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine
PubChem CID62492452
Molecular FormulaC12H14N4
Molecular Weight214.27 g/mol
Exact Mass214.12
IUPAC Name[4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine
SMILESNCc1cc(-n2ccc(C3CC3)n2)ccn1
InChIInChI=1S/C12H14N4/c13-8-10-7-11(3-5-14-10)16-6-4-12(15-16)9-1-2-9/h3-7,9H,1-2,8,13H2
InChIKeyQNXQWUHWYTYZJG-UHFFFAOYSA-N
XLogP1.60
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine?
The IUPAC name of [4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine (CID 62492452) is [4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine.
What is the SMILES notation for [4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine?
The canonical SMILES for [4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine is NCc1cc(-n2ccc(C3CC3)n2)ccn1.
What is the InChIKey of [4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine?
The InChIKey is QNXQWUHWYTYZJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4/c13-8-10-7-11(3-5-14-10)16-6-4-12(15-16)9-1-2-9/h3-7,9H,1-2,8,13H2.
What are the key properties of [4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine?
[4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine has a molecular weight of 214.27 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-cyclopropylpyrazol-1-yl)-2-pyridinyl]methanamine is sourced from PubChem (CID 62492452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).