5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine

C14H24N2 — CID 80708442

IUPAC5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine
SMILESCc1ccc(CNC(C)CCC(C)C)nc1
InChIInChI=1S/C14H24N2/c1-11(2)5-7-13(4)15-10-14-8-6-12(3)9-16-14/h6,8-9,11,13,15H,5,7,10H2,1-4H3
InChIKeyCKXCFTBAVUXHPD-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.30
Rot. Bonds6

About 5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine

5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine (PubChem CID 80708442) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine.

Molecular Properties

Compound Name5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine
PubChem CID80708442
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine
SMILESCc1ccc(CNC(C)CCC(C)C)nc1
InChIInChI=1S/C14H24N2/c1-11(2)5-7-13(4)15-10-14-8-6-12(3)9-16-14/h6,8-9,11,13,15H,5,7,10H2,1-4H3
InChIKeyCKXCFTBAVUXHPD-UHFFFAOYSA-N
XLogP3.30
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(5-methyl-2-pyridinyl)methylamino]butan-1-ol
CID 80709131
(2S)-2-[(5-methyl-2-pyridinyl)methylamino]propan-1-ol
CID 103773833
N-[(5-methyl-2-pyridinyl)methyl]pent-4-yn-2-amine
CID 115699019
1-(2-methylphenyl)-N-[(5-methyl-2-pyridinyl)methyl]propan-2-amine
CID 80707990
N-ethyl-4-(5-methyl-2-pyridinyl)butan-2-amine
CID 81312035
5-methyl-2-(3-methylbutyl)pyridine;hydrochloride
CID 172742279
1-(2-fluorophenyl)-N-[(5-methyl-2-pyridinyl)methyl]ethanamine
CID 80708851
1-(2-methoxyphenyl)-N-[(5-methyl-2-pyridinyl)methyl]ethanamine
CID 80708293
1-(1,5-dimethylpyrazol-4-yl)-N-[(5-methyl-2-pyridinyl)methyl]ethanamine
CID 80708616
3-methyl-2-[(5-methyl-2-pyridinyl)methylamino]butanoic acid
CID 81311715
(1R,3R)-3-[(5-methyl-2-pyridinyl)methylamino]-1-thiophen-2-ylbutan-1-ol
CID 97329293
2,2-dimethyl-N-[(5-methyl-2-pyridinyl)methyl]pentan-3-amine
CID 115698944

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine?
The IUPAC name of 5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine (CID 80708442) is 5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine.
What is the SMILES notation for 5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine?
The canonical SMILES for 5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine is Cc1ccc(CNC(C)CCC(C)C)nc1.
What is the InChIKey of 5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine?
The InChIKey is CKXCFTBAVUXHPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-11(2)5-7-13(4)15-10-14-8-6-12(3)9-16-14/h6,8-9,11,13,15H,5,7,10H2,1-4H3.
What are the key properties of 5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine?
5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine has a molecular weight of 220.36 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[(5-methyl-2-pyridinyl)methyl]hexan-2-amine is sourced from PubChem (CID 80708442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).