1-[methyl(methylamino)amino]propan-1-amine

C5H15N3 — CID 170033538

IUPAC1-[methyl(methylamino)amino]propan-1-amine
SMILESCCC(N)N(C)NC
InChIInChI=1S/C5H15N3/c1-4-5(6)8(3)7-2/h5,7H,4,6H2,1-3H3
InChIKeyMLDKMAJGWGZOQB-UHFFFAOYSA-N
MW117.20 g/mol
LogP-0.25
Rot. Bonds3

About 1-[methyl(methylamino)amino]propan-1-amine

1-[methyl(methylamino)amino]propan-1-amine (PubChem CID 170033538) has the molecular formula C5H15N3 and a molecular weight of 117.20 g/mol. Its IUPAC name is 1-[methyl(methylamino)amino]propan-1-amine.

Molecular Properties

Compound Name1-[methyl(methylamino)amino]propan-1-amine
PubChem CID170033538
Molecular FormulaC5H15N3
Molecular Weight117.20 g/mol
Exact Mass117.13
IUPAC Name1-[methyl(methylamino)amino]propan-1-amine
SMILESCCC(N)N(C)NC
InChIInChI=1S/C5H15N3/c1-4-5(6)8(3)7-2/h5,7H,4,6H2,1-3H3
InChIKeyMLDKMAJGWGZOQB-UHFFFAOYSA-N
XLogP-0.25
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.20
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(1R)-1-N',1-N'-dimethylpropane-1,1-diamine
CID 92569177
1-N'-ethyl-1-N'-methylpropane-1,1-diamine
CID 18987876
amino-[methyl(methylamino)amino]methanol
CID 140976107
N-methyl-2-[methyl(methylamino)amino]propan-1-amine
CID 147867609
N"-butan-2-yl-N',N"-dimethylmethanetriamine
CID 129045479
1-chloropropan-1-amine;N,N-dimethylmethanamine
CID 87947838
1-N'-(3-aminopropyl)-1-N'-methylpropane-1,1-diamine
CID 22987584
1-N',1-N'-dimethylpropane-1,1-diamine;2-hydroxypropanoic acid
CID 87204764
molecular hydrogen;(2S)-1-N,1-N,2-N-trimethylbutane-1,2-diamine
CID 176566866
hexane-3,4-diamine
CID 12656175
1-hydrazinyl-N',N'-dimethylethane-1,2-diamine
CID 57104181
1-N-methyl-1-N',1-N'-bis(methylamino)propane-1,1-diamine
CID 175151430

Frequently Asked Questions

What is the IUPAC name of 1-[methyl(methylamino)amino]propan-1-amine?
The IUPAC name of 1-[methyl(methylamino)amino]propan-1-amine (CID 170033538) is 1-[methyl(methylamino)amino]propan-1-amine.
What is the SMILES notation for 1-[methyl(methylamino)amino]propan-1-amine?
The canonical SMILES for 1-[methyl(methylamino)amino]propan-1-amine is CCC(N)N(C)NC.
What is the InChIKey of 1-[methyl(methylamino)amino]propan-1-amine?
The InChIKey is MLDKMAJGWGZOQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H15N3/c1-4-5(6)8(3)7-2/h5,7H,4,6H2,1-3H3.
What are the key properties of 1-[methyl(methylamino)amino]propan-1-amine?
1-[methyl(methylamino)amino]propan-1-amine has a molecular weight of 117.20 g/mol, XLogP of -0.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[methyl(methylamino)amino]propan-1-amine is sourced from PubChem (CID 170033538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).