N-methyl-N-prop-1-en-2-ylprop-1-en-2-amine

C7H13N — CID 23150838

IUPACN-methyl-N-prop-1-en-2-ylprop-1-en-2-amine
SMILESC=C(C)N(C)C(=C)C
InChIInChI=1S/C7H13N/c1-6(2)8(5)7(3)4/h1,3H2,2,4-5H3
InChIKeyYAGKCBZESGTUJX-UHFFFAOYSA-N
MW111.19 g/mol
LogP1.99
Rot. Bonds2

About N-methyl-N-prop-1-en-2-ylprop-1-en-2-amine

N-methyl-N-prop-1-en-2-ylprop-1-en-2-amine (PubChem CID 23150838) has the molecular formula C7H13N and a molecular weight of 111.19 g/mol. Its IUPAC name is N-methyl-N-prop-1-en-2-ylprop-1-en-2-amine.

Molecular Properties

Compound NameN-methyl-N-prop-1-en-2-ylprop-1-en-2-amine
PubChem CID23150838
Molecular FormulaC7H13N
Molecular Weight111.19 g/mol
Exact Mass111.10
IUPAC NameN-methyl-N-prop-1-en-2-ylprop-1-en-2-amine
SMILESC=C(C)N(C)C(=C)C
InChIInChI=1S/C7H13N/c1-6(2)8(5)7(3)4/h1,3H2,2,4-5H3
InChIKeyYAGKCBZESGTUJX-UHFFFAOYSA-N
XLogP1.99
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.19
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-prop-1-en-2-ylprop-1-en-2-amine?
The IUPAC name of N-methyl-N-prop-1-en-2-ylprop-1-en-2-amine (CID 23150838) is N-methyl-N-prop-1-en-2-ylprop-1-en-2-amine.
What is the SMILES notation for N-methyl-N-prop-1-en-2-ylprop-1-en-2-amine?
The canonical SMILES for N-methyl-N-prop-1-en-2-ylprop-1-en-2-amine is C=C(C)N(C)C(=C)C.
What is the InChIKey of N-methyl-N-prop-1-en-2-ylprop-1-en-2-amine?
The InChIKey is YAGKCBZESGTUJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N/c1-6(2)8(5)7(3)4/h1,3H2,2,4-5H3.
What are the key properties of N-methyl-N-prop-1-en-2-ylprop-1-en-2-amine?
N-methyl-N-prop-1-en-2-ylprop-1-en-2-amine has a molecular weight of 111.19 g/mol, XLogP of 1.99, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-prop-1-en-2-ylprop-1-en-2-amine is sourced from PubChem (CID 23150838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).