(1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride

C10H15ClN2 — CID 171201503

IUPAC(1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride
SMILESCl.N[C@H](CC1CC1)c1cccnc1
InChIInChI=1S/C10H14N2.ClH/c11-10(6-8-3-4-8)9-2-1-5-12-7-9;/h1-2,5,7-8,10H,3-4,6,11H2;1H/t10-;/m1./s1
InChIKeyZLNZMGZOAMVHOH-HNCPQSOCSA-N
MW198.70 g/mol
LogP2.30
Rot. Bonds3

About (1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride

(1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride (PubChem CID 171201503) has the molecular formula C10H15ClN2 and a molecular weight of 198.70 g/mol. Its IUPAC name is (1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride.

Molecular Properties

Compound Name(1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride
PubChem CID171201503
Molecular FormulaC10H15ClN2
Molecular Weight198.70 g/mol
Exact Mass198.09
IUPAC Name(1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride
SMILESCl.N[C@H](CC1CC1)c1cccnc1
InChIInChI=1S/C10H14N2.ClH/c11-10(6-8-3-4-8)9-2-1-5-12-7-9;/h1-2,5,7-8,10H,3-4,6,11H2;1H/t10-;/m1./s1
InChIKeyZLNZMGZOAMVHOH-HNCPQSOCSA-N
XLogP2.30
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.70
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride?
The IUPAC name of (1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride (CID 171201503) is (1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride.
What is the SMILES notation for (1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride?
The canonical SMILES for (1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride is Cl.N[C@H](CC1CC1)c1cccnc1.
What is the InChIKey of (1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride?
The InChIKey is ZLNZMGZOAMVHOH-HNCPQSOCSA-N. The full InChI is InChI=1S/C10H14N2.ClH/c11-10(6-8-3-4-8)9-2-1-5-12-7-9;/h1-2,5,7-8,10H,3-4,6,11H2;1H/t10-;/m1./s1.
What are the key properties of (1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride?
(1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride has a molecular weight of 198.70 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-cyclopropyl-1-pyridin-3-ylethanamine;hydrochloride is sourced from PubChem (CID 171201503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).