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

C6H11N — CID 21468402

IUPACN-prop-1-en-2-ylprop-1-en-2-amine
SMILESC=C(C)NC(=C)C
InChIInChI=1S/C6H11N/c1-5(2)7-6(3)4/h7H,1,3H2,2,4H3
InChIKeyYYKGMZQGKRHLCK-UHFFFAOYSA-N
MW97.16 g/mol
LogP1.64
Rot. Bonds2

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

N-prop-1-en-2-ylprop-1-en-2-amine (PubChem CID 21468402) has the molecular formula C6H11N and a molecular weight of 97.16 g/mol. Its IUPAC name is N-prop-1-en-2-ylprop-1-en-2-amine.

Molecular Properties

Compound NameN-prop-1-en-2-ylprop-1-en-2-amine
PubChem CID21468402
Molecular FormulaC6H11N
Molecular Weight97.16 g/mol
Exact Mass97.09
IUPAC NameN-prop-1-en-2-ylprop-1-en-2-amine
SMILESC=C(C)NC(=C)C
InChIInChI=1S/C6H11N/c1-5(2)7-6(3)4/h7H,1,3H2,2,4H3
InChIKeyYYKGMZQGKRHLCK-UHFFFAOYSA-N
XLogP1.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.16
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-prop-1-en-2-ylprop-1-en-2-amine?
The IUPAC name of N-prop-1-en-2-ylprop-1-en-2-amine (CID 21468402) is N-prop-1-en-2-ylprop-1-en-2-amine.
What is the SMILES notation for N-prop-1-en-2-ylprop-1-en-2-amine?
The canonical SMILES for N-prop-1-en-2-ylprop-1-en-2-amine is C=C(C)NC(=C)C.
What is the InChIKey of N-prop-1-en-2-ylprop-1-en-2-amine?
The InChIKey is YYKGMZQGKRHLCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N/c1-5(2)7-6(3)4/h7H,1,3H2,2,4H3.
What are the key properties of N-prop-1-en-2-ylprop-1-en-2-amine?
N-prop-1-en-2-ylprop-1-en-2-amine has a molecular weight of 97.16 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-1-en-2-ylprop-1-en-2-amine is sourced from PubChem (CID 21468402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).