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

C11H19N3 — CID 79267853

IUPACN'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine
SMILESCc1cccc(CN(C)CCCN)n1
InChIInChI=1S/C11H19N3/c1-10-5-3-6-11(13-10)9-14(2)8-4-7-12/h3,5-6H,4,7-9,12H2,1-2H3
InChIKeyDYNNFOJJKIXCNC-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.17
Rot. Bonds5

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

N'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine (PubChem CID 79267853) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine.

Molecular Properties

Compound NameN'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine
PubChem CID79267853
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine
SMILESCc1cccc(CN(C)CCCN)n1
InChIInChI=1S/C11H19N3/c1-10-5-3-6-11(13-10)9-14(2)8-4-7-12/h3,5-6H,4,7-9,12H2,1-2H3
InChIKeyDYNNFOJJKIXCNC-UHFFFAOYSA-N
XLogP1.17
TPSA42.15 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 ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(3-methoxyphenyl)-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine
CID 79262673
N-methyl-N-[(6-methyl-2-pyridinyl)methyl]acetamide
CID 23402951
N'-(2-methoxyphenyl)-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine
CID 79262674
N'-(2,2-difluoroethyl)-N'-[(6-methyl-2-pyridinyl)methyl]ethane-1,2-diamine
CID 107494419
ethane;N-methyl-N-[(6-methyl-2-pyridinyl)methyl]acetamide
CID 143432699
N'-methyl-N-(2-methylpropyl)-N'-[(6-methyl-2-pyridinyl)methyl]ethane-1,2-diamine
CID 79267629
2-chloro-N-methyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine
CID 79260632
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-methyl-1-(6-methyl-2-pyridinyl)methanamine
CID 113311854
N'-hydroxy-2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]ethanimidamide
CID 79267709
N'-[(2-bromo-3-fluorophenyl)methyl]-N'-methylpropane-1,3-diamine
CID 115319274
2-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]-1-phenylethanone
CID 14590944
(Z)-2-ethyl-4-[methyl-[(6-methyl-2-pyridinyl)methyl]amino]but-2-enoic acid
CID 134000503

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine?
The IUPAC name of N'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine (CID 79267853) is N'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine.
What is the SMILES notation for N'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine?
The canonical SMILES for N'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine is Cc1cccc(CN(C)CCCN)n1.
What is the InChIKey of N'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine?
The InChIKey is DYNNFOJJKIXCNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-10-5-3-6-11(13-10)9-14(2)8-4-7-12/h3,5-6H,4,7-9,12H2,1-2H3.
What are the key properties of N'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine?
N'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine has a molecular weight of 193.29 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N'-[(6-methyl-2-pyridinyl)methyl]propane-1,3-diamine is sourced from PubChem (CID 79267853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).