1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine

C13H21N5 — CID 122167464

IUPAC1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine
SMILESCCCn1nc(C)cc1CNc1cnn(CC)c1
InChIInChI=1S/C13H21N5/c1-4-6-18-13(7-11(3)16-18)9-14-12-8-15-17(5-2)10-12/h7-8,10,14H,4-6,9H2,1-3H3
InChIKeySYURGFGTFXLAIV-UHFFFAOYSA-N
MW247.35 g/mol
LogP2.43
Rot. Bonds6

About 1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine

1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine (PubChem CID 122167464) has the molecular formula C13H21N5 and a molecular weight of 247.35 g/mol. Its IUPAC name is 1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine.

Molecular Properties

Compound Name1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine
PubChem CID122167464
Molecular FormulaC13H21N5
Molecular Weight247.35 g/mol
Exact Mass247.18
IUPAC Name1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine
SMILESCCCn1nc(C)cc1CNc1cnn(CC)c1
InChIInChI=1S/C13H21N5/c1-4-6-18-13(7-11(3)16-18)9-14-12-8-15-17(5-2)10-12/h7-8,10,14H,4-6,9H2,1-3H3
InChIKeySYURGFGTFXLAIV-UHFFFAOYSA-N
XLogP2.43
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.35
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-ethyl-N-[(3-methyl-1-propylpyrazol-4-yl)methyl]pyrazol-4-amine
CID 122167620
1-ethyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-4-amine;hydrochloride
CID 126964986
1-ethyl-N-[(2-ethylpyrazol-3-yl)methyl]pyrazol-4-amine
CID 19626405
1-ethyl-N-[(2-ethylpyrazol-3-yl)methyl]pyrazol-4-amine;hydrochloride
CID 126965183
N,1-diethylpyrazol-4-amine
CID 43543394
N-[(3-methyl-1-propylpyrazol-4-yl)methyl]-1-propylpyrazol-4-amine
CID 122167629
1-ethyl-N-[(5-fluoro-1,3-dimethylpyrazol-4-yl)methyl]pyrazol-4-amine
CID 122169134
1-propyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-4-amine;hydrochloride
CID 126965152
1-ethyl-N-(2-methylpentyl)pyrazol-4-amine
CID 43543330
1-methyl-N-[(3-propylimidazol-4-yl)methyl]pyrazol-4-amine
CID 66135408
2-[4-[(1-ethylpyrazol-4-yl)methylamino]pyrazol-1-yl]ethanol
CID 122166813
1-ethyl-N-[(4-propoxyphenyl)methyl]pyrazol-4-amine
CID 43543347

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine?
The IUPAC name of 1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine (CID 122167464) is 1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine.
What is the SMILES notation for 1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine?
The canonical SMILES for 1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine is CCCn1nc(C)cc1CNc1cnn(CC)c1.
What is the InChIKey of 1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine?
The InChIKey is SYURGFGTFXLAIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5/c1-4-6-18-13(7-11(3)16-18)9-14-12-8-15-17(5-2)10-12/h7-8,10,14H,4-6,9H2,1-3H3.
What are the key properties of 1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine?
1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine has a molecular weight of 247.35 g/mol, XLogP of 2.43, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine is sourced from PubChem (CID 122167464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).