1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine

C10H13N5 — CID 62760929

IUPAC1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine
SMILESCCn1cc(NCc2ccncn2)cn1
InChIInChI=1S/C10H13N5/c1-2-15-7-10(6-14-15)12-5-9-3-4-11-8-13-9/h3-4,6-8,12H,2,5H2,1H3
InChIKeyAYTIDJGKHUPUOB-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.31
Rot. Bonds4

About 1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine

1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine (PubChem CID 62760929) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is 1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine.

Molecular Properties

Compound Name1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine
PubChem CID62760929
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC Name1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine
SMILESCCn1cc(NCc2ccncn2)cn1
InChIInChI=1S/C10H13N5/c1-2-15-7-10(6-14-15)12-5-9-3-4-11-8-13-9/h3-4,6-8,12H,2,5H2,1H3
InChIKeyAYTIDJGKHUPUOB-UHFFFAOYSA-N
XLogP1.31
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-ethyl-N-[(2-ethylpyrazol-3-yl)methyl]pyrazol-4-amine
CID 19626405
N,1-diethylpyrazol-4-amine
CID 43543394
1-ethyl-N-[(2-ethylpyrazol-3-yl)methyl]pyrazol-4-amine;hydrochloride
CID 126965183
4-[[(1-ethylpyrazol-4-yl)amino]methyl]phenol
CID 19627559
5-methyl-N-(pyrimidin-4-ylmethyl)pyridin-3-amine
CID 107584713
4-methylsulfanyl-N-(pyrimidin-4-ylmethyl)aniline
CID 62760028
N-[(2-tert-butyl-1,3-thiazol-4-yl)methyl]-1-ethylpyrazol-4-amine
CID 113341585
N-[(4-ethoxyphenyl)methyl]-1-ethylpyrazol-4-amine;hydrochloride
CID 126966280
4-iodo-N-(pyrimidin-4-ylmethyl)aniline
CID 62760584
1-ethyl-N-[(4-propoxyphenyl)methyl]pyrazol-4-amine
CID 43543347
N-(1-ethylpyrazol-4-yl)-1-pyridin-4-ylpiperidin-4-amine
CID 43543272
1-(2-methoxyethyl)-N-[(5-methyl-2-pyridinyl)methyl]pyrazol-4-amine
CID 81312279

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine?
The IUPAC name of 1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine (CID 62760929) is 1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine.
What is the SMILES notation for 1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine?
The canonical SMILES for 1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine is CCn1cc(NCc2ccncn2)cn1.
What is the InChIKey of 1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine?
The InChIKey is AYTIDJGKHUPUOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c1-2-15-7-10(6-14-15)12-5-9-3-4-11-8-13-9/h3-4,6-8,12H,2,5H2,1H3.
What are the key properties of 1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine?
1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine has a molecular weight of 203.25 g/mol, XLogP of 1.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(pyrimidin-4-ylmethyl)pyrazol-4-amine is sourced from PubChem (CID 62760929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).