N',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine

C11H19N3 — CID 60876998

IUPACN',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine
SMILESCc1cccc(NCCCN(C)C)n1
InChIInChI=1S/C11H19N3/c1-10-6-4-7-11(13-10)12-8-5-9-14(2)3/h4,6-7H,5,8-9H2,1-3H3,(H,12,13)
InChIKeyOUAKOENLRNOQJD-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.75
Rot. Bonds5

About N',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine

N',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine (PubChem CID 60876998) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine.

Molecular Properties

Compound NameN',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine
PubChem CID60876998
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine
SMILESCc1cccc(NCCCN(C)C)n1
InChIInChI=1S/C11H19N3/c1-10-6-4-7-11(13-10)12-8-5-9-14(2)3/h4,6-7H,5,8-9H2,1-3H3,(H,12,13)
InChIKeyOUAKOENLRNOQJD-UHFFFAOYSA-N
XLogP1.75
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-N-[3-(dimethylamino)propyl]-2-N-methylpyridine-2,6-diamine
CID 80778351
N-(6-fluoro-2-pyridinyl)-N',N'-dimethylpropane-1,3-diamine
CID 61228791
N-[3-(dimethylamino)propyl]-N'-(6-methyl-2-pyridinyl)oxamide
CID 44997594
6-methyl-N-(7-methyloctyl)pyridin-2-amine
CID 107816090
N,N-dimethyl-3-[(6-methyl-2-pyridinyl)amino]propanamide
CID 60926392
N'-[(4-fluorophenyl)methyl]-N'-methyl-N-(6-methyl-2-pyridinyl)ethane-1,2-diamine
CID 133483867
3-[(6-methyl-2-pyridinyl)amino]propanenitrile
CID 130918867
N-(6-fluoro-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine
CID 61229371
4-N-[3-(dimethylamino)propyl]-2-N,6-dimethyl-2-N-phenylpyrimidine-2,4-diamine
CID 112913498
6-[3-(dimethylamino)propoxy]-N-propylpyridin-2-amine
CID 80871017
ethyl 4-[(6-methyl-2-pyridinyl)amino]butanoate
CID 64579139
1-[2-[(6-methyl-2-pyridinyl)amino]ethylamino]propan-2-ol
CID 104594292

Frequently Asked Questions

What is the IUPAC name of N',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine?
The IUPAC name of N',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine (CID 60876998) is N',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine.
What is the SMILES notation for N',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine?
The canonical SMILES for N',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine is Cc1cccc(NCCCN(C)C)n1.
What is the InChIKey of N',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine?
The InChIKey is OUAKOENLRNOQJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-10-6-4-7-11(13-10)12-8-5-9-14(2)3/h4,6-7H,5,8-9H2,1-3H3,(H,12,13).
What are the key properties of N',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine?
N',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine has a molecular weight of 193.29 g/mol, XLogP of 1.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethyl-N-(6-methyl-2-pyridinyl)propane-1,3-diamine is sourced from PubChem (CID 60876998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).