N'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine

C9H20N2 — CID 126603357

IUPACN'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine
SMILESC=C(CC(C)(C)C)NCCN
InChIInChI=1S/C9H20N2/c1-8(11-6-5-10)7-9(2,3)4/h11H,1,5-7,10H2,2-4H3
InChIKeyOBBAMCUPHHYOPY-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.48
Rot. Bonds4

About N'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine

N'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine (PubChem CID 126603357) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is N'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine
PubChem CID126603357
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC NameN'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine
SMILESC=C(CC(C)(C)C)NCCN
InChIInChI=1S/C9H20N2/c1-8(11-6-5-10)7-9(2,3)4/h11H,1,5-7,10H2,2-4H3
InChIKeyOBBAMCUPHHYOPY-UHFFFAOYSA-N
XLogP1.48
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4,4-dimethylpent-1-en-2-yl)-N'-(3,3,3-trifluoroprop-1-en-2-yl)butane-1,4-diamine
CID 134441684
2-fluoro-3,3-dimethyl-N-(3-methylbut-1-en-2-yl)butan-1-amine
CID 153602081
N-(4,4-dimethylpent-1-en-2-yl)-1-(3-fluoropropyl)azetidin-3-amine
CID 174197139
1-N,2-N-bis(4,4-dimethylpent-1-en-2-yl)-3,3,3-trifluoropropane-1,2-diamine
CID 174329365
1-(3,3-Dimethylpent-1-en-2-yl)piperazine
CID 18717508
N-butyl-3-methylpent-1-en-2-amine
CID 18717521
1,7,7-Trimethyl-8-methylidene-1,4-diazocane
CID 57785857
3,3-dimethyl-N-prop-1-en-2-ylbutan-1-amine
CID 58530871
2-N-(2-methylpent-1-en-3-yl)-3-N-prop-1-en-2-ylpent-1-ene-2,3-diamine
CID 58987143
N-butyl-3,3-dimethylpent-1-en-2-amine
CID 59096553
N'-but-1-en-2-yl-N-ethylethane-1,2-diamine
CID 59197969
N,4,4-trimethylpent-1-en-2-amine
CID 59850104

Frequently Asked Questions

What is the IUPAC name of N'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine?
The IUPAC name of N'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine (CID 126603357) is N'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine?
The canonical SMILES for N'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine is C=C(CC(C)(C)C)NCCN.
What is the InChIKey of N'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine?
The InChIKey is OBBAMCUPHHYOPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2/c1-8(11-6-5-10)7-9(2,3)4/h11H,1,5-7,10H2,2-4H3.
What are the key properties of N'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine?
N'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine has a molecular weight of 156.27 g/mol, XLogP of 1.48, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4,4-dimethylpent-1-en-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 126603357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).