3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine

C7H19N3 — CID 115119484

IUPAC3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine
SMILESCC(C)N(C)CC(N)CN
InChIInChI=1S/C7H19N3/c1-6(2)10(3)5-7(9)4-8/h6-7H,4-5,8-9H2,1-3H3
InChIKeyNYETXHIBJVQLOI-UHFFFAOYSA-N
MW145.25 g/mol
LogP-0.39
Rot. Bonds4

About 3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine

3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine (PubChem CID 115119484) has the molecular formula C7H19N3 and a molecular weight of 145.25 g/mol. Its IUPAC name is 3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine.

Molecular Properties

Compound Name3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine
PubChem CID115119484
Molecular FormulaC7H19N3
Molecular Weight145.25 g/mol
Exact Mass145.16
IUPAC Name3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine
SMILESCC(C)N(C)CC(N)CN
InChIInChI=1S/C7H19N3/c1-6(2)10(3)5-7(9)4-8/h6-7H,4-5,8-9H2,1-3H3
InChIKeyNYETXHIBJVQLOI-UHFFFAOYSA-N
XLogP-0.39
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-N,4-dimethyl-1-N-propan-2-ylpentane-1,2-diamine
CID 43199687
3-amino-4-[methyl(propan-2-yl)amino]butanoic acid
CID 115241535
1-N,3,3-trimethyl-1-N-propan-2-ylbutane-1,2-diamine
CID 16795578
(2S)-1-[methyl(propan-2-yl)amino]propan-2-ol
CID 93346500
N,3-dimethyl-2-[3-methyl-1-[methyl(propan-2-yl)amino]butan-2-yl]peroxy-N-propan-2-ylbutan-1-amine
CID 126577485
1-N,5-N-dimethyl-3-[[methyl(propan-2-yl)amino]methyl]-1-N,5-N-di(propan-2-yl)pentane-1,2,5-triamine
CID 122628336
1-N-butan-2-yl-3-methoxy-1-N-methylpropane-1,2-diamine
CID 63761505
3-N-(cyclopentylmethyl)-3-N-methylpropane-1,2,3-triamine
CID 115119915
3-ethyl-2-N-methyl-2-N-(3-methylbutyl)pentane-1,2-diamine
CID 61425759
(2S)-N-methyl-2-methylsulfanyl-N-propan-2-ylpropan-1-amine
CID 166781330
CID 166489938
CID 166489938
1-N-butan-2-yl-4-methoxy-1-N-methylbutane-1,2-diamine
CID 62475612

Frequently Asked Questions

What is the IUPAC name of 3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine?
The IUPAC name of 3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine (CID 115119484) is 3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine.
What is the SMILES notation for 3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine?
The canonical SMILES for 3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine is CC(C)N(C)CC(N)CN.
What is the InChIKey of 3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine?
The InChIKey is NYETXHIBJVQLOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19N3/c1-6(2)10(3)5-7(9)4-8/h6-7H,4-5,8-9H2,1-3H3.
What are the key properties of 3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine?
3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine has a molecular weight of 145.25 g/mol, XLogP of -0.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-methyl-3-N-propan-2-ylpropane-1,2,3-triamine is sourced from PubChem (CID 115119484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).