3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine

C9H15N3 — CID 83861613

IUPAC3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine
SMILESCCc1n[nH]c2c1C(NC)CC2
InChIInChI=1S/C9H15N3/c1-3-6-9-7(10-2)4-5-8(9)12-11-6/h7,10H,3-5H2,1-2H3,(H,11,12)
InChIKeyUVRJJJCYOMLNDY-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.18
Rot. Bonds2

About 3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine

3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine (PubChem CID 83861613) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine.

Molecular Properties

Compound Name3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine
PubChem CID83861613
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine
SMILESCCc1n[nH]c2c1C(NC)CC2
InChIInChI=1S/C9H15N3/c1-3-6-9-7(10-2)4-5-8(9)12-11-6/h7,10H,3-5H2,1-2H3,(H,11,12)
InChIKeyUVRJJJCYOMLNDY-UHFFFAOYSA-N
XLogP1.18
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine?
The IUPAC name of 3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine (CID 83861613) is 3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine.
What is the SMILES notation for 3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine?
The canonical SMILES for 3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine is CCc1n[nH]c2c1C(NC)CC2.
What is the InChIKey of 3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine?
The InChIKey is UVRJJJCYOMLNDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-3-6-9-7(10-2)4-5-8(9)12-11-6/h7,10H,3-5H2,1-2H3,(H,11,12).
What are the key properties of 3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine?
3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine has a molecular weight of 165.24 g/mol, XLogP of 1.18, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazol-4-amine is sourced from PubChem (CID 83861613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).