2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine

C9H15N3 — CID 67770440

IUPAC2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine
SMILESCN(c1cccnc1)C(C)(C)N
InChIInChI=1S/C9H15N3/c1-9(2,10)12(3)8-5-4-6-11-7-8/h4-7H,10H2,1-3H3
InChIKeyNCHZNQLFTDALJR-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.21
Rot. Bonds2

About 2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine

2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine (PubChem CID 67770440) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine.

Molecular Properties

Compound Name2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine
PubChem CID67770440
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine
SMILESCN(c1cccnc1)C(C)(C)N
InChIInChI=1S/C9H15N3/c1-9(2,10)12(3)8-5-4-6-11-7-8/h4-7H,10H2,1-3H3
InChIKeyNCHZNQLFTDALJR-UHFFFAOYSA-N
XLogP1.21
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-2-[methyl(pyridin-3-yl)amino]propan-1-ol
CID 115133332
N,N-dimethylpyridin-3-amine;hydrochloride
CID 23028557
formaldehyde;1-methyl-1-pyridin-3-ylhydrazine
CID 143631457
1-N,1-N,3-trimethyl-1-pyridin-3-ylbutane-1,3-diamine
CID 116905090
methyl N,N'-dimethyl-N-pyridin-3-ylcarbamimidothioate
CID 45116234
3-[tert-butyl(sulfinato)amino]pyridine
CID 123766222
N-methyl-N-pyridin-3-ylcarbamoyl chloride
CID 115194564
2-methyl-1-pyridin-3-ylpropan-2-amine;dihydrochloride
CID 131637820
(2S)-2-pyridin-3-ylbutan-2-amine
CID 93358668
4-tert-butyl-N-methyl-N-pyridin-3-ylbenzenesulfonamide
CID 110752641
N-tert-butyl-N-prop-2-enylpyridin-3-amine
CID 59409529
3,3-dimethyl-4-[methyl(pyridin-3-yl)amino]-4-oxobutanoic acid
CID 115164800

Frequently Asked Questions

What is the IUPAC name of 2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine?
The IUPAC name of 2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine (CID 67770440) is 2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine.
What is the SMILES notation for 2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine?
The canonical SMILES for 2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine is CN(c1cccnc1)C(C)(C)N.
What is the InChIKey of 2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine?
The InChIKey is NCHZNQLFTDALJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-9(2,10)12(3)8-5-4-6-11-7-8/h4-7H,10H2,1-3H3.
What are the key properties of 2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine?
2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine has a molecular weight of 165.24 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N'-methyl-2-N'-pyridin-3-ylpropane-2,2-diamine is sourced from PubChem (CID 67770440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).