1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine

C8H13N3 — CID 105422572

IUPAC1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine
SMILESCC(N)c1[nH]ncc1C1CC1
InChIInChI=1S/C8H13N3/c1-5(9)8-7(4-10-11-8)6-2-3-6/h4-6H,2-3,9H2,1H3,(H,10,11)
InChIKeyNAIQHGSNGZWVAR-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.31
Rot. Bonds2

About 1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine

1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine (PubChem CID 105422572) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine.

Molecular Properties

Compound Name1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine
PubChem CID105422572
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine
SMILESCC(N)c1[nH]ncc1C1CC1
InChIInChI=1S/C8H13N3/c1-5(9)8-7(4-10-11-8)6-2-3-6/h4-6H,2-3,9H2,1H3,(H,10,11)
InChIKeyNAIQHGSNGZWVAR-UHFFFAOYSA-N
XLogP1.31
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine?
The IUPAC name of 1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine (CID 105422572) is 1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine.
What is the SMILES notation for 1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine?
The canonical SMILES for 1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine is CC(N)c1[nH]ncc1C1CC1.
What is the InChIKey of 1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine?
The InChIKey is NAIQHGSNGZWVAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-5(9)8-7(4-10-11-8)6-2-3-6/h4-6H,2-3,9H2,1H3,(H,10,11).
What are the key properties of 1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine?
1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine has a molecular weight of 151.21 g/mol, XLogP of 1.31, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopropyl-1H-pyrazol-5-yl)ethanamine is sourced from PubChem (CID 105422572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).