2-ethylpropane-1,3-diamine

C5H14N2 — CID 14499053

IUPAC2-ethylpropane-1,3-diamine
SMILESCCC(CN)CN
InChIInChI=1S/C5H14N2/c1-2-5(3-6)4-7/h5H,2-4,6-7H2,1H3
InChIKeyGLXTZKCNKVYLPF-UHFFFAOYSA-N
MW102.18 g/mol
LogP-0.07
Rot. Bonds3

About 2-ethylpropane-1,3-diamine

2-ethylpropane-1,3-diamine (PubChem CID 14499053) has the molecular formula C5H14N2 and a molecular weight of 102.18 g/mol. Its IUPAC name is 2-ethylpropane-1,3-diamine.

Molecular Properties

Compound Name2-ethylpropane-1,3-diamine
PubChem CID14499053
Molecular FormulaC5H14N2
Molecular Weight102.18 g/mol
Exact Mass102.12
IUPAC Name2-ethylpropane-1,3-diamine
SMILESCCC(CN)CN
InChIInChI=1S/C5H14N2/c1-2-5(3-6)4-7/h5H,2-4,6-7H2,1H3
InChIKeyGLXTZKCNKVYLPF-UHFFFAOYSA-N
XLogP-0.07
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.18
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-diethylpentane-1,5-diamine;ethanamine
CID 162225203
2-(aminomethyl)butane-1-thiol;hydrochloride
CID 155665114
(2S)-2-ethylhexan-1-amine
CID 6999997
2-(trimethylsilylmethyl)butan-1-amine
CID 106323031
2-ethyl-4,5-dimethylhexan-1-amine
CID 147299389
2-ethylhexan-1-amine;hydrate
CID 173045208
2-ethylhexan-1-amine;dihydrochloride
CID 142641821
ethane;2-ethyl-N'-methylpropane-1,3-diamine
CID 144511427
2-ethylundecane-1,11-diamine
CID 118354607
N',2-diethyl-N'-methylpropane-1,3-diamine;propane
CID 142151966
N',2-diethylbutane-1,4-diamine
CID 81080470
5-ethylheptane-1,2-diamine
CID 57197564

Frequently Asked Questions

What is the IUPAC name of 2-ethylpropane-1,3-diamine?
The IUPAC name of 2-ethylpropane-1,3-diamine (CID 14499053) is 2-ethylpropane-1,3-diamine.
What is the SMILES notation for 2-ethylpropane-1,3-diamine?
The canonical SMILES for 2-ethylpropane-1,3-diamine is CCC(CN)CN.
What is the InChIKey of 2-ethylpropane-1,3-diamine?
The InChIKey is GLXTZKCNKVYLPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2/c1-2-5(3-6)4-7/h5H,2-4,6-7H2,1H3.
What are the key properties of 2-ethylpropane-1,3-diamine?
2-ethylpropane-1,3-diamine has a molecular weight of 102.18 g/mol, XLogP of -0.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylpropane-1,3-diamine is sourced from PubChem (CID 14499053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).