N'-ethyl-N'-methylpropane-1,3-diamine

C6H16N2 — CID 15667718

IUPACN'-ethyl-N'-methylpropane-1,3-diamine
SMILESCCN(C)CCCN
InChIInChI=1S/C6H16N2/c1-3-8(2)6-4-5-7/h3-7H2,1-2H3
InChIKeyFRVNYRKFLIOCNF-UHFFFAOYSA-N
MW116.21 g/mol
LogP0.29
Rot. Bonds4

About N'-ethyl-N'-methylpropane-1,3-diamine

N'-ethyl-N'-methylpropane-1,3-diamine (PubChem CID 15667718) has the molecular formula C6H16N2 and a molecular weight of 116.21 g/mol. Its IUPAC name is N'-ethyl-N'-methylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-ethyl-N'-methylpropane-1,3-diamine
PubChem CID15667718
Molecular FormulaC6H16N2
Molecular Weight116.21 g/mol
Exact Mass116.13
IUPAC NameN'-ethyl-N'-methylpropane-1,3-diamine
SMILESCCN(C)CCCN
InChIInChI=1S/C6H16N2/c1-3-8(2)6-4-5-7/h3-7H2,1-2H3
InChIKeyFRVNYRKFLIOCNF-UHFFFAOYSA-N
XLogP0.29
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.21
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N'-ethyl-N'-methylpropane-1,3-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Spermidine
CID 1102
N,N-Dimethyl-1,3-propanediamine
CID 7993
Bis(3-aminopropyl)amine
CID 5942
N,N-Diethyl-1,3-propanediamine
CID 61011
N'-(3-(Dimethylamino)propyl)-N,N-dimethyl-1,3-propanediamine
CID 81207
N-Methyl-1,3-propanediamine
CID 80511
N,N-bis(3-aminopropyl)methylamine
CID 7777
Dimethyldipropylenetriamine
CID 82728
Npc322806
CID 6992097
3-(Dibutylamino)propylamine
CID 1626
N-Propyl-1,3-propanediamine
CID 90250
N-Ethyl-1,3-propanediamine
CID 82727

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N'-methylpropane-1,3-diamine?
The IUPAC name of N'-ethyl-N'-methylpropane-1,3-diamine (CID 15667718) is N'-ethyl-N'-methylpropane-1,3-diamine.
What is the SMILES notation for N'-ethyl-N'-methylpropane-1,3-diamine?
The canonical SMILES for N'-ethyl-N'-methylpropane-1,3-diamine is CCN(C)CCCN.
What is the InChIKey of N'-ethyl-N'-methylpropane-1,3-diamine?
The InChIKey is FRVNYRKFLIOCNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N2/c1-3-8(2)6-4-5-7/h3-7H2,1-2H3.
What are the key properties of N'-ethyl-N'-methylpropane-1,3-diamine?
N'-ethyl-N'-methylpropane-1,3-diamine has a molecular weight of 116.21 g/mol, XLogP of 0.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N'-methylpropane-1,3-diamine is sourced from PubChem (CID 15667718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).