azane;3-methylpentane-2,3-diamine

C6H19N3 — CID 174323665

IUPACazane;3-methylpentane-2,3-diamine
SMILESCCC(C)(N)C(C)N.N
InChIInChI=1S/C6H16N2.H3N/c1-4-6(3,8)5(2)7;/h5H,4,7-8H2,1-3H3;1H3
InChIKeyTXILQNCAJAJYRK-UHFFFAOYSA-N
MW133.24 g/mol
LogP0.62
Rot. Bonds2

About azane;3-methylpentane-2,3-diamine

azane;3-methylpentane-2,3-diamine (PubChem CID 174323665) has the molecular formula C6H19N3 and a molecular weight of 133.24 g/mol. Its IUPAC name is azane;3-methylpentane-2,3-diamine.

Molecular Properties

Compound Nameazane;3-methylpentane-2,3-diamine
PubChem CID174323665
Molecular FormulaC6H19N3
Molecular Weight133.24 g/mol
Exact Mass133.16
IUPAC Nameazane;3-methylpentane-2,3-diamine
SMILESCCC(C)(N)C(C)N.N
InChIInChI=1S/C6H16N2.H3N/c1-4-6(3,8)5(2)7;/h5H,4,7-8H2,1-3H3;1H3
InChIKeyTXILQNCAJAJYRK-UHFFFAOYSA-N
XLogP0.62
TPSA87.04 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.24
LogP ≤ 50.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-3-methylpentan-2-ol
CID 159077240
2,3-dimethylpentane-1,3-diamine
CID 141278294
3-methoxy-3-methylpentan-2-amine
CID 116757359
3,4-diethyl-3-iodo-4-methylhexan-2-amine
CID 163902899
3-ethyl-3,5-dimethylhexan-2-amine
CID 146359872
3-amino-2-hydroxy-3-methylpentanoic acid
CID 55290367
(2R)-3-ethyl-3-methylpent-4-en-2-amine
CID 143354853
3,3,4,4,5,5-hexamethylheptane
CID 22899431
2-methylbutan-2-amine;propane
CID 91035545
2-methylbutan-2-amine;hydrate
CID 173000674
2,3,3-trimethylpentane-2,4-diamine
CID 22186538
2-methyl-1-(1-methylsulfanylethoxy)propan-2-amine
CID 137419061

Frequently Asked Questions

What is the IUPAC name of azane;3-methylpentane-2,3-diamine?
The IUPAC name of azane;3-methylpentane-2,3-diamine (CID 174323665) is azane;3-methylpentane-2,3-diamine.
What is the SMILES notation for azane;3-methylpentane-2,3-diamine?
The canonical SMILES for azane;3-methylpentane-2,3-diamine is CCC(C)(N)C(C)N.N.
What is the InChIKey of azane;3-methylpentane-2,3-diamine?
The InChIKey is TXILQNCAJAJYRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N2.H3N/c1-4-6(3,8)5(2)7;/h5H,4,7-8H2,1-3H3;1H3.
What are the key properties of azane;3-methylpentane-2,3-diamine?
azane;3-methylpentane-2,3-diamine has a molecular weight of 133.24 g/mol, XLogP of 0.62, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azane;3-methylpentane-2,3-diamine is sourced from PubChem (CID 174323665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).