1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine

C11H17N3 — CID 130908640

IUPAC1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine
SMILESCc1cncc(CNC2CN(C)C2)c1
InChIInChI=1S/C11H17N3/c1-9-3-10(5-12-4-9)6-13-11-7-14(2)8-11/h3-5,11,13H,6-8H2,1-2H3
InChIKeyLEXCHPWTIZQTKI-UHFFFAOYSA-N
MW191.28 g/mol
LogP0.79
Rot. Bonds3

About 1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine

1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine (PubChem CID 130908640) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine.

Molecular Properties

Compound Name1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine
PubChem CID130908640
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine
SMILESCc1cncc(CNC2CN(C)C2)c1
InChIInChI=1S/C11H17N3/c1-9-3-10(5-12-4-9)6-13-11-7-14(2)8-11/h3-5,11,13H,6-8H2,1-2H3
InChIKeyLEXCHPWTIZQTKI-UHFFFAOYSA-N
XLogP0.79
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-methyl-3-pyridinyl)methyl]thian-4-amine
CID 103864382
4-methyl-N-[(5-methyl-3-pyridinyl)methyl]piperazin-1-amine
CID 102881009
2,2-dicyclopropyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine
CID 102880910
2-[(5-methyl-3-pyridinyl)methylamino]cyclohexan-1-ol
CID 102880835
N-[(5-methyl-3-pyridinyl)methyl]formamide
CID 142430826
2-chloro-N-[(5-methyl-3-pyridinyl)methyl]cycloheptan-1-amine
CID 102879005
N-[[1-[(5-methyl-3-pyridinyl)methyl]imidazol-4-yl]methyl]cyclopropanamine
CID 106719982
(1S)-1-cyclopentyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine
CID 102880981
1,1-dimethyl-2-[(5-methyl-3-pyridinyl)methyl]hydrazine
CID 102881007
(1S)-1-cyclohexyl-N-[(5-methyl-3-pyridinyl)methyl]ethanamine
CID 102880979
1-methyl-N-(1H-pyrrol-3-ylmethyl)azetidin-3-amine
CID 131043183
ethane;1-methyl-4-[(5-methyl-3-pyridinyl)methyl]piperazine
CID 143962339

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine?
The IUPAC name of 1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine (CID 130908640) is 1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine.
What is the SMILES notation for 1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine?
The canonical SMILES for 1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine is Cc1cncc(CNC2CN(C)C2)c1.
What is the InChIKey of 1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine?
The InChIKey is LEXCHPWTIZQTKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-9-3-10(5-12-4-9)6-13-11-7-14(2)8-11/h3-5,11,13H,6-8H2,1-2H3.
What are the key properties of 1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine?
1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine has a molecular weight of 191.28 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[(5-methyl-3-pyridinyl)methyl]azetidin-3-amine is sourced from PubChem (CID 130908640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).