N-methylmethanamine;N-prop-2-enylpropan-1-amine

C8H20N2 — CID 18466419

IUPACN-methylmethanamine;N-prop-2-enylpropan-1-amine
SMILESC=CCNCCC.CNC
InChIInChI=1S/C6H13N.C2H7N/c1-3-5-7-6-4-2;1-3-2/h3,7H,1,4-6H2,2H3;3H,1-2H3
InChIKeyRESZBSLNUDSIMC-UHFFFAOYSA-N
MW144.26 g/mol
LogP1.01
Rot. Bonds4

About N-methylmethanamine;N-prop-2-enylpropan-1-amine

N-methylmethanamine;N-prop-2-enylpropan-1-amine (PubChem CID 18466419) has the molecular formula C8H20N2 and a molecular weight of 144.26 g/mol. Its IUPAC name is N-methylmethanamine;N-prop-2-enylpropan-1-amine.

Molecular Properties

Compound NameN-methylmethanamine;N-prop-2-enylpropan-1-amine
PubChem CID18466419
Molecular FormulaC8H20N2
Molecular Weight144.26 g/mol
Exact Mass144.16
IUPAC NameN-methylmethanamine;N-prop-2-enylpropan-1-amine
SMILESC=CCNCCC.CNC
InChIInChI=1S/C6H13N.C2H7N/c1-3-5-7-6-4-2;1-3-2/h3,7H,1,4-6H2,2H3;3H,1-2H3
InChIKeyRESZBSLNUDSIMC-UHFFFAOYSA-N
XLogP1.01
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.26
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methylmethanamine;N-prop-2-enylpropan-1-amine?
The IUPAC name of N-methylmethanamine;N-prop-2-enylpropan-1-amine (CID 18466419) is N-methylmethanamine;N-prop-2-enylpropan-1-amine.
What is the SMILES notation for N-methylmethanamine;N-prop-2-enylpropan-1-amine?
The canonical SMILES for N-methylmethanamine;N-prop-2-enylpropan-1-amine is C=CCNCCC.CNC.
What is the InChIKey of N-methylmethanamine;N-prop-2-enylpropan-1-amine?
The InChIKey is RESZBSLNUDSIMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N.C2H7N/c1-3-5-7-6-4-2;1-3-2/h3,7H,1,4-6H2,2H3;3H,1-2H3.
What are the key properties of N-methylmethanamine;N-prop-2-enylpropan-1-amine?
N-methylmethanamine;N-prop-2-enylpropan-1-amine has a molecular weight of 144.26 g/mol, XLogP of 1.01, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylmethanamine;N-prop-2-enylpropan-1-amine is sourced from PubChem (CID 18466419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).