(3-cyclopropylcyclobutyl)methanamine;hydrochloride

C8H16ClN — CID 138040746

IUPAC(3-cyclopropylcyclobutyl)methanamine;hydrochloride
SMILESCl.NCC1CC(C2CC2)C1
InChIInChI=1S/C8H15N.ClH/c9-5-6-3-8(4-6)7-1-2-7;/h6-8H,1-5,9H2;1H
InChIKeyABFOVPHIGDIIPD-UHFFFAOYSA-N
MW161.68 g/mol
LogP1.80
Rot. Bonds2

About (3-cyclopropylcyclobutyl)methanamine;hydrochloride

(3-cyclopropylcyclobutyl)methanamine;hydrochloride (PubChem CID 138040746) has the molecular formula C8H16ClN and a molecular weight of 161.68 g/mol. Its IUPAC name is (3-cyclopropylcyclobutyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(3-cyclopropylcyclobutyl)methanamine;hydrochloride
PubChem CID138040746
Molecular FormulaC8H16ClN
Molecular Weight161.68 g/mol
Exact Mass161.10
IUPAC Name(3-cyclopropylcyclobutyl)methanamine;hydrochloride
SMILESCl.NCC1CC(C2CC2)C1
InChIInChI=1S/C8H15N.ClH/c9-5-6-3-8(4-6)7-1-2-7;/h6-8H,1-5,9H2;1H
InChIKeyABFOVPHIGDIIPD-UHFFFAOYSA-N
XLogP1.80
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.68
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3-cyclopropylcyclobutyl)methanamine;hydrochloride?
The IUPAC name of (3-cyclopropylcyclobutyl)methanamine;hydrochloride (CID 138040746) is (3-cyclopropylcyclobutyl)methanamine;hydrochloride.
What is the SMILES notation for (3-cyclopropylcyclobutyl)methanamine;hydrochloride?
The canonical SMILES for (3-cyclopropylcyclobutyl)methanamine;hydrochloride is Cl.NCC1CC(C2CC2)C1.
What is the InChIKey of (3-cyclopropylcyclobutyl)methanamine;hydrochloride?
The InChIKey is ABFOVPHIGDIIPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N.ClH/c9-5-6-3-8(4-6)7-1-2-7;/h6-8H,1-5,9H2;1H.
What are the key properties of (3-cyclopropylcyclobutyl)methanamine;hydrochloride?
(3-cyclopropylcyclobutyl)methanamine;hydrochloride has a molecular weight of 161.68 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropylcyclobutyl)methanamine;hydrochloride is sourced from PubChem (CID 138040746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).