N'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine

C10H23N3 — CID 89212435

IUPACN'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine
SMILESC=NCCCN(CC)CCCNC
InChIInChI=1S/C10H23N3/c1-4-13(9-5-7-11-2)10-6-8-12-3/h12H,2,4-10H2,1,3H3
InChIKeyUVWYFMDJCZISLG-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.01
Rot. Bonds9

About N'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine

N'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine (PubChem CID 89212435) has the molecular formula C10H23N3 and a molecular weight of 185.31 g/mol. Its IUPAC name is N'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine.

Molecular Properties

Compound NameN'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine
PubChem CID89212435
Molecular FormulaC10H23N3
Molecular Weight185.31 g/mol
Exact Mass185.19
IUPAC NameN'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine
SMILESC=NCCCN(CC)CCCNC
InChIInChI=1S/C10H23N3/c1-4-13(9-5-7-11-2)10-6-8-12-3/h12H,2,4-10H2,1,3H3
InChIKeyUVWYFMDJCZISLG-UHFFFAOYSA-N
XLogP1.01
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N'-ethyl-N-methyl-N'-[2-(methylamino)ethyl]propane-1,3-diamine
CID 142226092
N',N'-diethyl-N-methylpropane-1,3-diamine;molecular hydrogen;propane
CID 156874721
N'-[3-(dimethylamino)propyl]-N'-ethyl-N-methylhexane-1,6-diamine
CID 102997503
N'-ethyl-N-methyl-N'-(4-methylpentyl)ethane-1,2-diamine
CID 134316858
2-[ethyl-[2-(methylamino)ethyl]amino]ethanol;formaldehyde
CID 143070492
N'-[3-[cyclopropyl(oxetan-3-yl)amino]propyl]-N'-ethyl-N-methylpropane-1,3-diamine
CID 145216933
N',N'-diethyl-N-methylethane-1,2-diamine;ethane
CID 142004273
N'-ethyl-N-methyl-N'-propylethane-1,2-diamine
CID 21015837
N'-[[2-[3-(dimethylamino)propyl]hydrazinyl]methyl]-N'-ethyl-N-methylethane-1,2-diamine
CID 139553651
N'-ethyl-N,N'-dimethylpropane-1,3-diamine;N-ethyl-N-methylbutan-1-amine;N,N',N'-triethylpropane-1,3-diamine
CID 159847702
N',N'-bis(2-methoxyethyl)-N-methylpropane-1,3-diamine
CID 61418451
N'-butyl-N'-ethyl-N-propylpropane-1,3-diamine
CID 61386892

Frequently Asked Questions

What is the IUPAC name of N'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine?
The IUPAC name of N'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine (CID 89212435) is N'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine.
What is the SMILES notation for N'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine?
The canonical SMILES for N'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine is C=NCCCN(CC)CCCNC.
What is the InChIKey of N'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine?
The InChIKey is UVWYFMDJCZISLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3/c1-4-13(9-5-7-11-2)10-6-8-12-3/h12H,2,4-10H2,1,3H3.
What are the key properties of N'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine?
N'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine has a molecular weight of 185.31 g/mol, XLogP of 1.01, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-N-methyl-N'-[3-(methylideneamino)propyl]propane-1,3-diamine is sourced from PubChem (CID 89212435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).