(3,3-dimethylcyclobutyl)methanamine;hydrochloride

C7H16ClN — CID 72716216

IUPAC(3,3-dimethylcyclobutyl)methanamine;hydrochloride
SMILESCC1(C)CC(CN)C1.Cl
InChIInChI=1S/C7H15N.ClH/c1-7(2)3-6(4-7)5-8;/h6H,3-5,8H2,1-2H3;1H
InChIKeyAXSYVJNWIVPTHY-UHFFFAOYSA-N
MW149.66 g/mol
LogP1.80
Rot. Bonds1

About (3,3-dimethylcyclobutyl)methanamine;hydrochloride

(3,3-dimethylcyclobutyl)methanamine;hydrochloride (PubChem CID 72716216) has the molecular formula C7H16ClN and a molecular weight of 149.66 g/mol. Its IUPAC name is (3,3-dimethylcyclobutyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(3,3-dimethylcyclobutyl)methanamine;hydrochloride
PubChem CID72716216
Molecular FormulaC7H16ClN
Molecular Weight149.66 g/mol
Exact Mass149.10
IUPAC Name(3,3-dimethylcyclobutyl)methanamine;hydrochloride
SMILESCC1(C)CC(CN)C1.Cl
InChIInChI=1S/C7H15N.ClH/c1-7(2)3-6(4-7)5-8;/h6H,3-5,8H2,1-2H3;1H
InChIKeyAXSYVJNWIVPTHY-UHFFFAOYSA-N
XLogP1.80
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.66
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3,3-dimethylcyclobutyl)methanamine;hydrochloride?
The IUPAC name of (3,3-dimethylcyclobutyl)methanamine;hydrochloride (CID 72716216) is (3,3-dimethylcyclobutyl)methanamine;hydrochloride.
What is the SMILES notation for (3,3-dimethylcyclobutyl)methanamine;hydrochloride?
The canonical SMILES for (3,3-dimethylcyclobutyl)methanamine;hydrochloride is CC1(C)CC(CN)C1.Cl.
What is the InChIKey of (3,3-dimethylcyclobutyl)methanamine;hydrochloride?
The InChIKey is AXSYVJNWIVPTHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N.ClH/c1-7(2)3-6(4-7)5-8;/h6H,3-5,8H2,1-2H3;1H.
What are the key properties of (3,3-dimethylcyclobutyl)methanamine;hydrochloride?
(3,3-dimethylcyclobutyl)methanamine;hydrochloride has a molecular weight of 149.66 g/mol, XLogP of 1.80, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-dimethylcyclobutyl)methanamine;hydrochloride is sourced from PubChem (CID 72716216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).