(Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine

C6H14N2 — CID 121353934

IUPAC(Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine
SMILESCCN/C=C(/C)CN
InChIInChI=1S/C6H14N2/c1-3-8-5-6(2)4-7/h5,8H,3-4,7H2,1-2H3/b6-5-
InChIKeyKNWCCBGMXZYGFV-WAYWQWQTSA-N
MW114.19 g/mol
LogP0.46
Rot. Bonds3

About (Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine

(Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine (PubChem CID 121353934) has the molecular formula C6H14N2 and a molecular weight of 114.19 g/mol. Its IUPAC name is (Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine.

Molecular Properties

Compound Name(Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine
PubChem CID121353934
Molecular FormulaC6H14N2
Molecular Weight114.19 g/mol
Exact Mass114.12
IUPAC Name(Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine
SMILESCCN/C=C(/C)CN
InChIInChI=1S/C6H14N2/c1-3-8-5-6(2)4-7/h5,8H,3-4,7H2,1-2H3/b6-5-
InChIKeyKNWCCBGMXZYGFV-WAYWQWQTSA-N
XLogP0.46
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine?
The IUPAC name of (Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine (CID 121353934) is (Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine.
What is the SMILES notation for (Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine?
The canonical SMILES for (Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine is CCN/C=C(/C)CN.
What is the InChIKey of (Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine?
The InChIKey is KNWCCBGMXZYGFV-WAYWQWQTSA-N. The full InChI is InChI=1S/C6H14N2/c1-3-8-5-6(2)4-7/h5,8H,3-4,7H2,1-2H3/b6-5-.
What are the key properties of (Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine?
(Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine has a molecular weight of 114.19 g/mol, XLogP of 0.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethyl-2-methylprop-1-ene-1,3-diamine is sourced from PubChem (CID 121353934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).