N-methylmethanamine;propan-1-amine;trihydrochloride

C5H19Cl3N2 — CID 174050669

IUPACN-methylmethanamine;propan-1-amine;trihydrochloride
SMILESCCCN.CNC.Cl.Cl.Cl
InChIInChI=1S/C3H9N.C2H7N.3ClH/c1-2-3-4;1-3-2;;;/h2-4H2,1H3;3H,1-2H3;3*1H
InChIKeyZWCUWXQIALNUFV-UHFFFAOYSA-N
MW213.58 g/mol
LogP1.46
Rot. Bonds1

About N-methylmethanamine;propan-1-amine;trihydrochloride

N-methylmethanamine;propan-1-amine;trihydrochloride (PubChem CID 174050669) has the molecular formula C5H19Cl3N2 and a molecular weight of 213.58 g/mol. Its IUPAC name is N-methylmethanamine;propan-1-amine;trihydrochloride.

Molecular Properties

Compound NameN-methylmethanamine;propan-1-amine;trihydrochloride
PubChem CID174050669
Molecular FormulaC5H19Cl3N2
Molecular Weight213.58 g/mol
Exact Mass212.06
IUPAC NameN-methylmethanamine;propan-1-amine;trihydrochloride
SMILESCCCN.CNC.Cl.Cl.Cl
InChIInChI=1S/C3H9N.C2H7N.3ClH/c1-2-3-4;1-3-2;;;/h2-4H2,1H3;3H,1-2H3;3*1H
InChIKeyZWCUWXQIALNUFV-UHFFFAOYSA-N
XLogP1.46
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.58
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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ethane;methanamine;bis(propan-1-amine)
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cyclohexane;propan-1-amine
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2-methylpropan-2-amine;propan-1-amine
CID 19917238
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Frequently Asked Questions

What is the IUPAC name of N-methylmethanamine;propan-1-amine;trihydrochloride?
The IUPAC name of N-methylmethanamine;propan-1-amine;trihydrochloride (CID 174050669) is N-methylmethanamine;propan-1-amine;trihydrochloride.
What is the SMILES notation for N-methylmethanamine;propan-1-amine;trihydrochloride?
The canonical SMILES for N-methylmethanamine;propan-1-amine;trihydrochloride is CCCN.CNC.Cl.Cl.Cl.
What is the InChIKey of N-methylmethanamine;propan-1-amine;trihydrochloride?
The InChIKey is ZWCUWXQIALNUFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N.C2H7N.3ClH/c1-2-3-4;1-3-2;;;/h2-4H2,1H3;3H,1-2H3;3*1H.
What are the key properties of N-methylmethanamine;propan-1-amine;trihydrochloride?
N-methylmethanamine;propan-1-amine;trihydrochloride has a molecular weight of 213.58 g/mol, XLogP of 1.46, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylmethanamine;propan-1-amine;trihydrochloride is sourced from PubChem (CID 174050669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).