(1-benzylcyclopropyl)methanamine;hydrochloride

C11H16ClN — CID 86277151

IUPAC(1-benzylcyclopropyl)methanamine;hydrochloride
SMILESCl.NCC1(Cc2ccccc2)CC1
InChIInChI=1S/C11H15N.ClH/c12-9-11(6-7-11)8-10-4-2-1-3-5-10;/h1-5H,6-9,12H2;1H
InChIKeyUFYLOHBDHBHCAV-UHFFFAOYSA-N
MW197.71 g/mol
LogP2.39
Rot. Bonds3

About (1-benzylcyclopropyl)methanamine;hydrochloride

(1-benzylcyclopropyl)methanamine;hydrochloride (PubChem CID 86277151) has the molecular formula C11H16ClN and a molecular weight of 197.71 g/mol. Its IUPAC name is (1-benzylcyclopropyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(1-benzylcyclopropyl)methanamine;hydrochloride
PubChem CID86277151
Molecular FormulaC11H16ClN
Molecular Weight197.71 g/mol
Exact Mass197.10
IUPAC Name(1-benzylcyclopropyl)methanamine;hydrochloride
SMILESCl.NCC1(Cc2ccccc2)CC1
InChIInChI=1S/C11H15N.ClH/c12-9-11(6-7-11)8-10-4-2-1-3-5-10;/h1-5H,6-9,12H2;1H
InChIKeyUFYLOHBDHBHCAV-UHFFFAOYSA-N
XLogP2.39
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.71
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1-benzylcyclopropyl)methanamine;hydrochloride?
The IUPAC name of (1-benzylcyclopropyl)methanamine;hydrochloride (CID 86277151) is (1-benzylcyclopropyl)methanamine;hydrochloride.
What is the SMILES notation for (1-benzylcyclopropyl)methanamine;hydrochloride?
The canonical SMILES for (1-benzylcyclopropyl)methanamine;hydrochloride is Cl.NCC1(Cc2ccccc2)CC1.
What is the InChIKey of (1-benzylcyclopropyl)methanamine;hydrochloride?
The InChIKey is UFYLOHBDHBHCAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N.ClH/c12-9-11(6-7-11)8-10-4-2-1-3-5-10;/h1-5H,6-9,12H2;1H.
What are the key properties of (1-benzylcyclopropyl)methanamine;hydrochloride?
(1-benzylcyclopropyl)methanamine;hydrochloride has a molecular weight of 197.71 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzylcyclopropyl)methanamine;hydrochloride is sourced from PubChem (CID 86277151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).