5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine

C14H23N5 — CID 103570396

IUPAC5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine
SMILESCCCn1c(C(C)C)nc(-c2cnn(CC)c2)c1N
InChIInChI=1S/C14H23N5/c1-5-7-19-13(15)12(17-14(19)10(3)4)11-8-16-18(6-2)9-11/h8-10H,5-7,15H2,1-4H3
InChIKeyUMTUTVRYKJHGPO-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.88
Rot. Bonds5

About 5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine

5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine (PubChem CID 103570396) has the molecular formula C14H23N5 and a molecular weight of 261.37 g/mol. Its IUPAC name is 5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine.

Molecular Properties

Compound Name5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine
PubChem CID103570396
Molecular FormulaC14H23N5
Molecular Weight261.37 g/mol
Exact Mass261.20
IUPAC Name5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine
SMILESCCCn1c(C(C)C)nc(-c2cnn(CC)c2)c1N
InChIInChI=1S/C14H23N5/c1-5-7-19-13(15)12(17-14(19)10(3)4)11-8-16-18(6-2)9-11/h8-10H,5-7,15H2,1-4H3
InChIKeyUMTUTVRYKJHGPO-UHFFFAOYSA-N
XLogP2.88
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 ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine?
The IUPAC name of 5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine (CID 103570396) is 5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine.
What is the SMILES notation for 5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine?
The canonical SMILES for 5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine is CCCn1c(C(C)C)nc(-c2cnn(CC)c2)c1N.
What is the InChIKey of 5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine?
The InChIKey is UMTUTVRYKJHGPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5/c1-5-7-19-13(15)12(17-14(19)10(3)4)11-8-16-18(6-2)9-11/h8-10H,5-7,15H2,1-4H3.
What are the key properties of 5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine?
5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine has a molecular weight of 261.37 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-ethylpyrazol-4-yl)-2-propan-2-yl-3-propylimidazol-4-amine is sourced from PubChem (CID 103570396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).