[2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine

C11H17N3 — CID 121214351

IUPAC[2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine
SMILESNCc1c2c(nn1CC1CC1)CCC2
InChIInChI=1S/C11H17N3/c12-6-11-9-2-1-3-10(9)13-14(11)7-8-4-5-8/h8H,1-7,12H2
InChIKeyONKYXOXEGIORTC-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.24
Rot. Bonds3

About [2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine

[2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine (PubChem CID 121214351) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is [2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine.

Molecular Properties

Compound Name[2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine
PubChem CID121214351
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name[2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine
SMILESNCc1c2c(nn1CC1CC1)CCC2
InChIInChI=1S/C11H17N3/c12-6-11-9-2-1-3-10(9)13-14(11)7-8-4-5-8/h8H,1-7,12H2
InChIKeyONKYXOXEGIORTC-UHFFFAOYSA-N
XLogP1.24
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine?
The IUPAC name of [2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine (CID 121214351) is [2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine.
What is the SMILES notation for [2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine?
The canonical SMILES for [2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine is NCc1c2c(nn1CC1CC1)CCC2.
What is the InChIKey of [2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine?
The InChIKey is ONKYXOXEGIORTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c12-6-11-9-2-1-3-10(9)13-14(11)7-8-4-5-8/h8H,1-7,12H2.
What are the key properties of [2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine?
[2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine has a molecular weight of 191.28 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclopropylmethyl)-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-yl]methanamine is sourced from PubChem (CID 121214351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).