(3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride

C12H23ClN2 — CID 130701707

IUPAC(3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride
SMILESCl.N[C@@H]1CCN(C2CCCC2C2CC2)C1
InChIInChI=1S/C12H22N2.ClH/c13-10-6-7-14(8-10)12-3-1-2-11(12)9-4-5-9;/h9-12H,1-8,13H2;1H/t10-,11?,12?;/m1./s1
InChIKeyQTIJDFGRXQWURU-CVEKITNISA-N
MW230.78 g/mol
LogP2.02
Rot. Bonds2

About (3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride

(3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride (PubChem CID 130701707) has the molecular formula C12H23ClN2 and a molecular weight of 230.78 g/mol. Its IUPAC name is (3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride.

Molecular Properties

Compound Name(3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride
PubChem CID130701707
Molecular FormulaC12H23ClN2
Molecular Weight230.78 g/mol
Exact Mass230.15
IUPAC Name(3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride
SMILESCl.N[C@@H]1CCN(C2CCCC2C2CC2)C1
InChIInChI=1S/C12H22N2.ClH/c13-10-6-7-14(8-10)12-3-1-2-11(12)9-4-5-9;/h9-12H,1-8,13H2;1H/t10-,11?,12?;/m1./s1
InChIKeyQTIJDFGRXQWURU-CVEKITNISA-N
XLogP2.02
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.78
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride?
The IUPAC name of (3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride (CID 130701707) is (3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride.
What is the SMILES notation for (3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride?
The canonical SMILES for (3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride is Cl.N[C@@H]1CCN(C2CCCC2C2CC2)C1.
What is the InChIKey of (3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride?
The InChIKey is QTIJDFGRXQWURU-CVEKITNISA-N. The full InChI is InChI=1S/C12H22N2.ClH/c13-10-6-7-14(8-10)12-3-1-2-11(12)9-4-5-9;/h9-12H,1-8,13H2;1H/t10-,11?,12?;/m1./s1.
What are the key properties of (3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride?
(3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride has a molecular weight of 230.78 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(2-cyclopropylcyclopentyl)pyrrolidin-3-amine;hydrochloride is sourced from PubChem (CID 130701707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).