N',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine

C7H16N2 — CID 89371347

IUPACN',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine
SMILESC=C(C)NCCN(C)C
InChIInChI=1S/C7H16N2/c1-7(2)8-5-6-9(3)4/h8H,1,5-6H2,2-4H3
InChIKeyXPVVTDRPKTZSED-UHFFFAOYSA-N
MW128.22 g/mol
LogP0.67
Rot. Bonds4

About N',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine

N',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine (PubChem CID 89371347) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is N',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine
PubChem CID89371347
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC NameN',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine
SMILESC=C(C)NCCN(C)C
InChIInChI=1S/C7H16N2/c1-7(2)8-5-6-9(3)4/h8H,1,5-6H2,2-4H3
InChIKeyXPVVTDRPKTZSED-UHFFFAOYSA-N
XLogP0.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethylprop-1-en-2-amine
CID 11170914
N-(2-fluoroethyl)-N'-prop-1-en-2-ylethane-1,2-diamine
CID 153367845
1-N-(2-fluoropropyl)-1-N,2-N-dimethylprop-2-ene-1,2-diamine
CID 170727794
1-Methyl-3-methylidenepiperazine
CID 17920505
N'-prop-1-en-2-ylethane-1,2-diamine
CID 19094848
N'-prop-1-en-2-ylbutane-1,4-diamine
CID 20647369
1-Methyl-2-methylidenepiperazine
CID 21333562
1-Ethyl-3-methylidenepiperazine
CID 22980279
1-Prop-1-en-2-ylpiperazine
CID 53629752
2-Methylidene-1-propylpiperazine
CID 53630616
5-Methyl-1,2,3,4-tetrahydropyrazine
CID 53748640
2-(3-Methyl-4-propylpyrazin-1-yl)ethanamine
CID 57185637

Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine?
The IUPAC name of N',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine (CID 89371347) is N',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine.
What is the SMILES notation for N',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine?
The canonical SMILES for N',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine is C=C(C)NCCN(C)C.
What is the InChIKey of N',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine?
The InChIKey is XPVVTDRPKTZSED-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2/c1-7(2)8-5-6-9(3)4/h8H,1,5-6H2,2-4H3.
What are the key properties of N',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine?
N',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine has a molecular weight of 128.22 g/mol, XLogP of 0.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethyl-N-prop-1-en-2-ylethane-1,2-diamine is sourced from PubChem (CID 89371347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).