3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine

C13H22N2 — CID 103829141

IUPAC3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine
SMILESCCC(C)(CC)NCc1cnccc1C
InChIInChI=1S/C13H22N2/c1-5-13(4,6-2)15-10-12-9-14-8-7-11(12)3/h7-9,15H,5-6,10H2,1-4H3
InChIKeyWCZZLFOJGWLCNZ-UHFFFAOYSA-N
MW206.33 g/mol
LogP3.06
Rot. Bonds5

About 3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine

3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine (PubChem CID 103829141) has the molecular formula C13H22N2 and a molecular weight of 206.33 g/mol. Its IUPAC name is 3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine.

Molecular Properties

Compound Name3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine
PubChem CID103829141
Molecular FormulaC13H22N2
Molecular Weight206.33 g/mol
Exact Mass206.18
IUPAC Name3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine
SMILESCCC(C)(CC)NCc1cnccc1C
InChIInChI=1S/C13H22N2/c1-5-13(4,6-2)15-10-12-9-14-8-7-11(12)3/h7-9,15H,5-6,10H2,1-4H3
InChIKeyWCZZLFOJGWLCNZ-UHFFFAOYSA-N
XLogP3.06
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dimethyl-N-[(4-methyl-3-pyridinyl)methyl]butan-1-amine
CID 103460819
N-[(4-methyl-3-pyridinyl)methyl]pyridin-4-amine
CID 114956500
3-methyl-3-[(4-methyl-3-pyridinyl)methylamino]butanamide
CID 104580210
N-methyl-1-(4-methyl-3-pyridinyl)methanamine;dihydrochloride
CID 171316354
N-[(4-methyl-3-pyridinyl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine
CID 103828799
5-iodo-N-[(4-methyl-3-pyridinyl)methyl]pyrimidin-2-amine
CID 114956718
4,6-dimethyl-N-[(4-methyl-3-pyridinyl)methyl]pyrimidin-2-amine
CID 114956711
(4-methyl-3-pyridinyl)methylcyanamide
CID 114955581
3-methyl-N-[(4-methyl-3-pyridinyl)methyl]-1,2,4-oxadiazol-5-amine
CID 106659990
4-ethyl-3-methyl-N-[(4-methyl-3-pyridinyl)methyl]aniline
CID 114078614
5-chloro-N-[(4-methyl-3-pyridinyl)methyl]pyrimidin-2-amine
CID 114956528
tert-butyl N-[2-methyl-2-[(4-methyl-3-pyridinyl)methylamino]propyl]carbamate
CID 107249231

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine?
The IUPAC name of 3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine (CID 103829141) is 3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine.
What is the SMILES notation for 3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine?
The canonical SMILES for 3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine is CCC(C)(CC)NCc1cnccc1C.
What is the InChIKey of 3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine?
The InChIKey is WCZZLFOJGWLCNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2/c1-5-13(4,6-2)15-10-12-9-14-8-7-11(12)3/h7-9,15H,5-6,10H2,1-4H3.
What are the key properties of 3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine?
3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine has a molecular weight of 206.33 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(4-methyl-3-pyridinyl)methyl]pentan-3-amine is sourced from PubChem (CID 103829141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).