1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine

C14H23N5 — CID 105109199

IUPAC1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
SMILESCCn1cc(C(N)CCc2c(C)nn(C)c2C)cn1
InChIInChI=1S/C14H23N5/c1-5-19-9-12(8-16-19)14(15)7-6-13-10(2)17-18(4)11(13)3/h8-9,14H,5-7,15H2,1-4H3
InChIKeyGBRHRSPWCDQQFY-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.89
Rot. Bonds5

About 1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine

1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine (PubChem CID 105109199) has the molecular formula C14H23N5 and a molecular weight of 261.37 g/mol. Its IUPAC name is 1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine.

Molecular Properties

Compound Name1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
PubChem CID105109199
Molecular FormulaC14H23N5
Molecular Weight261.37 g/mol
Exact Mass261.20
IUPAC Name1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
SMILESCCn1cc(C(N)CCc2c(C)nn(C)c2C)cn1
InChIInChI=1S/C14H23N5/c1-5-19-9-12(8-16-19)14(15)7-6-13-10(2)17-18(4)11(13)3/h8-9,14H,5-7,15H2,1-4H3
InChIKeyGBRHRSPWCDQQFY-UHFFFAOYSA-N
XLogP1.89
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1-ethylpyrazol-4-yl)-N-methyl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
CID 105109061
[1-(1-propylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105288593
1-pyridin-3-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
CID 105098522
1-(3-methylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
CID 105090783
1-thiophen-3-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
CID 105154076
1-(1-ethylpyrazol-4-yl)pentan-1-amine
CID 79412573
1-(1-propylimidazol-2-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
CID 105148921
3-ethoxy-1-(1-ethylpyrazol-4-yl)propan-1-amine
CID 105109341
1-(1-ethylpyrazol-4-yl)decan-1-amine
CID 115816084
(2,5-dimethylpyrazol-3-yl)-(1-ethylpyrazol-4-yl)methanamine
CID 105109125
1-(1-ethylpyrazol-4-yl)-3-pyridin-2-ylpropan-1-amine
CID 105109214
1-(2,3,4-trifluorophenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
CID 105146531

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine?
The IUPAC name of 1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine (CID 105109199) is 1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine.
What is the SMILES notation for 1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine?
The canonical SMILES for 1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine is CCn1cc(C(N)CCc2c(C)nn(C)c2C)cn1.
What is the InChIKey of 1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine?
The InChIKey is GBRHRSPWCDQQFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5/c1-5-19-9-12(8-16-19)14(15)7-6-13-10(2)17-18(4)11(13)3/h8-9,14H,5-7,15H2,1-4H3.
What are the key properties of 1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine?
1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine has a molecular weight of 261.37 g/mol, XLogP of 1.89, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine is sourced from PubChem (CID 105109199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).