N',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine

C8H18N2 — CID 60686491

IUPACN',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine
SMILESC=C(C)CNCCN(C)C
InChIInChI=1S/C8H18N2/c1-8(2)7-9-5-6-10(3)4/h9H,1,5-7H2,2-4H3
InChIKeyGXFCJDZWMPPFMF-UHFFFAOYSA-N
MW142.25 g/mol
LogP0.71
Rot. Bonds5

About N',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine

N',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine (PubChem CID 60686491) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is N',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine
PubChem CID60686491
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC NameN',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine
SMILESC=C(C)CNCCN(C)C
InChIInChI=1S/C8H18N2/c1-8(2)7-9-5-6-10(3)4/h9H,1,5-7H2,2-4H3
InChIKeyGXFCJDZWMPPFMF-UHFFFAOYSA-N
XLogP0.71
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N1-(2-methyl-2-propenyl)-1,2-ethanediamine
CID 224772
N'-(2-aminoethyl)-N'-(1,1-difluoro-2-methylprop-2-enyl)ethane-1,2-diamine
CID 57486597
N,N'-dibutyl-2-methylidenepropane-1,3-diamine
CID 10608042
N'-ethyl-N'-(2-methylprop-2-enyl)-N-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 79261020
N'-methyl-N'-(2-methylprop-2-enyl)-N-(2,2,2-trifluoroethyl)ethane-1,2-diamine
CID 116288591
N'-(2-methylprop-2-enyl)propane-1,3-diamine
CID 62331906
1-(2-Methylallyl)piperazine
CID 1073878
(2S)-1-N-(2-methylprop-2-enyl)propane-1,2-diamine
CID 10011916
1-(3-Methyl-but-2-enyl)-piperazine
CID 10441904
N,N'-diethyl-2-methylidenepropane-1,3-diamine
CID 12427675
N-(2-Methyl-2-propen-1-yl)-1-butanamine
CID 14525031
N-[2-(dimethylamino)ethyl]-2-methylprop-2-enethioamide
CID 14876850

Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine?
The IUPAC name of N',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine (CID 60686491) is N',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine.
What is the SMILES notation for N',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine?
The canonical SMILES for N',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine is C=C(C)CNCCN(C)C.
What is the InChIKey of N',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine?
The InChIKey is GXFCJDZWMPPFMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-8(2)7-9-5-6-10(3)4/h9H,1,5-7H2,2-4H3.
What are the key properties of N',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine?
N',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine has a molecular weight of 142.25 g/mol, XLogP of 0.71, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethyl-N-(2-methylprop-2-enyl)ethane-1,2-diamine is sourced from PubChem (CID 60686491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).