(1-propan-2-ylcyclopropyl)methanamine;hydrochloride

C7H16ClN — CID 53398887

IUPAC(1-propan-2-ylcyclopropyl)methanamine;hydrochloride
SMILESCC(C)C1(CN)CC1.Cl
InChIInChI=1S/C7H15N.ClH/c1-6(2)7(5-8)3-4-7;/h6H,3-5,8H2,1-2H3;1H
InChIKeyGXOFVJYTKKLLKV-UHFFFAOYSA-N
MW149.66 g/mol
LogP1.80
Rot. Bonds2

About (1-propan-2-ylcyclopropyl)methanamine;hydrochloride

(1-propan-2-ylcyclopropyl)methanamine;hydrochloride (PubChem CID 53398887) has the molecular formula C7H16ClN and a molecular weight of 149.66 g/mol. Its IUPAC name is (1-propan-2-ylcyclopropyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(1-propan-2-ylcyclopropyl)methanamine;hydrochloride
PubChem CID53398887
Molecular FormulaC7H16ClN
Molecular Weight149.66 g/mol
Exact Mass149.10
IUPAC Name(1-propan-2-ylcyclopropyl)methanamine;hydrochloride
SMILESCC(C)C1(CN)CC1.Cl
InChIInChI=1S/C7H15N.ClH/c1-6(2)7(5-8)3-4-7;/h6H,3-5,8H2,1-2H3;1H
InChIKeyGXOFVJYTKKLLKV-UHFFFAOYSA-N
XLogP1.80
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
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 (1-propan-2-ylcyclopropyl)methanamine;hydrochloride?
The IUPAC name of (1-propan-2-ylcyclopropyl)methanamine;hydrochloride (CID 53398887) is (1-propan-2-ylcyclopropyl)methanamine;hydrochloride.
What is the SMILES notation for (1-propan-2-ylcyclopropyl)methanamine;hydrochloride?
The canonical SMILES for (1-propan-2-ylcyclopropyl)methanamine;hydrochloride is CC(C)C1(CN)CC1.Cl.
What is the InChIKey of (1-propan-2-ylcyclopropyl)methanamine;hydrochloride?
The InChIKey is GXOFVJYTKKLLKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N.ClH/c1-6(2)7(5-8)3-4-7;/h6H,3-5,8H2,1-2H3;1H.
What are the key properties of (1-propan-2-ylcyclopropyl)methanamine;hydrochloride?
(1-propan-2-ylcyclopropyl)methanamine;hydrochloride has a molecular weight of 149.66 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 (1-propan-2-ylcyclopropyl)methanamine;hydrochloride is sourced from PubChem (CID 53398887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).