N-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine

C15H16N4 — CID 115372598

IUPACN-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine
SMILESCCc1ccccc1CNc1ccn2nccc2n1
InChIInChI=1S/C15H16N4/c1-2-12-5-3-4-6-13(12)11-16-14-8-10-19-15(18-14)7-9-17-19/h3-10H,2,11H2,1H3,(H,16,18)
InChIKeyYZKGAVZDTDRDFZ-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.90
Rot. Bonds4

About N-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine

N-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine (PubChem CID 115372598) has the molecular formula C15H16N4 and a molecular weight of 252.32 g/mol. Its IUPAC name is N-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine.

Molecular Properties

Compound NameN-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine
PubChem CID115372598
Molecular FormulaC15H16N4
Molecular Weight252.32 g/mol
Exact Mass252.14
IUPAC NameN-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine
SMILESCCc1ccccc1CNc1ccn2nccc2n1
InChIInChI=1S/C15H16N4/c1-2-12-5-3-4-6-13(12)11-16-14-8-10-19-15(18-14)7-9-17-19/h3-10H,2,11H2,1H3,(H,16,18)
InChIKeyYZKGAVZDTDRDFZ-UHFFFAOYSA-N
XLogP2.90
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-fluorophenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 113296642
N-[(2-methoxy-3-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 115372377
N-(quinolin-8-ylmethyl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 115372657
N-(1,3-benzodioxol-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-5-amine
CID 115372431
N-[(5-bromo-2-fluorophenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 115372443
2-methyl-1-(pyrazolo[1,5-a]pyrimidin-5-ylamino)propan-2-ol
CID 115372604
N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylethane-1,2-diamine
CID 113296634
N-[(3-methylthiophen-2-yl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 115372644
N-[(2-ethylphenyl)methyl]-1-methylpyrazol-3-amine
CID 62392134
N',N'-diethyl-N-pyrazolo[1,5-a]pyrimidin-5-ylpropane-1,3-diamine
CID 115372327
N-[(3,4-difluorophenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 115372482
N-propan-2-yl-2-(pyrazolo[1,5-a]pyrimidin-5-ylamino)acetamide
CID 113296656

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine?
The IUPAC name of N-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine (CID 115372598) is N-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine.
What is the SMILES notation for N-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine?
The canonical SMILES for N-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine is CCc1ccccc1CNc1ccn2nccc2n1.
What is the InChIKey of N-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine?
The InChIKey is YZKGAVZDTDRDFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4/c1-2-12-5-3-4-6-13(12)11-16-14-8-10-19-15(18-14)7-9-17-19/h3-10H,2,11H2,1H3,(H,16,18).
What are the key properties of N-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine?
N-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine has a molecular weight of 252.32 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethylphenyl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine is sourced from PubChem (CID 115372598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).