N'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine

C6H14N2 — CID 55288959

IUPACN'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine
SMILESC/C=C(/C)NCCN
InChIInChI=1S/C6H14N2/c1-3-6(2)8-5-4-7/h3,8H,4-5,7H2,1-2H3/b6-3-
InChIKeyCEWGXRQQDSQRER-UTCJRWHESA-N
MW114.19 g/mol
LogP0.46
Rot. Bonds3

About N'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine

N'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine (PubChem CID 55288959) has the molecular formula C6H14N2 and a molecular weight of 114.19 g/mol. Its IUPAC name is N'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine
PubChem CID55288959
Molecular FormulaC6H14N2
Molecular Weight114.19 g/mol
Exact Mass114.12
IUPAC NameN'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine
SMILESC/C=C(/C)NCCN
InChIInChI=1S/C6H14N2/c1-3-6(2)8-5-4-7/h3,8H,4-5,7H2,1-2H3/b6-3-
InChIKeyCEWGXRQQDSQRER-UTCJRWHESA-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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Related Compounds

N'-(3-methylbuta-1,3-dien-2-yl)ethane-1,2-diamine
CID 90261773
[[(E)-but-2-en-2-yl]amino]methanol
CID 130429621
N-[2-[[(Z)-but-2-en-2-yl]amino]ethyl]formamide
CID 156718256
N-(2-aminoethyl)acetamide;ethanamine
CID 142425997
(Z)-3-amino-2-(2-aminoethylamino)but-2-enal
CID 134517746
N-(2-aminoethyl)-3-oxobutanamide
CID 3020471
(E)-N-(2-aminoethyl)-2-methylpent-2-enamide
CID 60966147
N,N'-bis(2-aminoethyl)but-2-enediamide
CID 86151646
2-(2-aminoethylamino)-3,3-bis(methylamino)prop-2-enal
CID 134444403
N'-(3-methylbut-2-enyl)ethane-1,2-diamine
CID 107899865
1-N,1-N,1-N-tris(2-aminoethyl)ethane-1,1,1-tricarboxamide
CID 15388023
acetic acid;N-(2-aminoethyl)octanamide
CID 161257212

Frequently Asked Questions

What is the IUPAC name of N'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine?
The IUPAC name of N'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine (CID 55288959) is N'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine.
What is the SMILES notation for N'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine?
The canonical SMILES for N'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine is C/C=C(/C)NCCN.
What is the InChIKey of N'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine?
The InChIKey is CEWGXRQQDSQRER-UTCJRWHESA-N. The full InChI is InChI=1S/C6H14N2/c1-3-6(2)8-5-4-7/h3,8H,4-5,7H2,1-2H3/b6-3-.
What are the key properties of N'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine?
N'-[(Z)-but-2-en-2-yl]ethane-1,2-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 N'-[(Z)-but-2-en-2-yl]ethane-1,2-diamine is sourced from PubChem (CID 55288959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).