6-methyl-3-pentylpyridin-2-amine

C11H18N2 — CID 167157111

IUPAC6-methyl-3-pentylpyridin-2-amine
SMILESCCCCCc1ccc(C)nc1N
InChIInChI=1S/C11H18N2/c1-3-4-5-6-10-8-7-9(2)13-11(10)12/h7-8H,3-6H2,1-2H3,(H2,12,13)
InChIKeyCBBXOQUNDOJYTC-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.70
Rot. Bonds4

About 6-methyl-3-pentylpyridin-2-amine

6-methyl-3-pentylpyridin-2-amine (PubChem CID 167157111) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 6-methyl-3-pentylpyridin-2-amine.

Molecular Properties

Compound Name6-methyl-3-pentylpyridin-2-amine
PubChem CID167157111
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name6-methyl-3-pentylpyridin-2-amine
SMILESCCCCCc1ccc(C)nc1N
InChIInChI=1S/C11H18N2/c1-3-4-5-6-10-8-7-9(2)13-11(10)12/h7-8H,3-6H2,1-2H3,(H2,12,13)
InChIKeyCBBXOQUNDOJYTC-UHFFFAOYSA-N
XLogP2.70
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-ethyl-6-methylpyridin-2-amine
CID 3016311
2,3-dimethyl-1,4-dipentylbenzene
CID 54478491
4-pentylpyridazin-3-amine
CID 69188714
5-hexylpyrimidine-2,4-diamine
CID 23086565
5-methyl-6-octylquinazoline-2,4-diamine
CID 14478923
3-octylquinolin-2-amine
CID 23131231
2-hexyl-3,6-dimethylpyridine
CID 23386704
5-[2-(4-ethylphenyl)ethyl]-6-methyl-3-pentylpyridin-2-amine
CID 167157109
2,4-dihexyl-3-methylaniline
CID 174875923
3-methyl-4-octylaniline
CID 139523093
5-ethyl-2-hexylaniline
CID 22065589
3-chloro-6-methyl-2-pentylpyridine;ethane
CID 177208340

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-pentylpyridin-2-amine?
The IUPAC name of 6-methyl-3-pentylpyridin-2-amine (CID 167157111) is 6-methyl-3-pentylpyridin-2-amine.
What is the SMILES notation for 6-methyl-3-pentylpyridin-2-amine?
The canonical SMILES for 6-methyl-3-pentylpyridin-2-amine is CCCCCc1ccc(C)nc1N.
What is the InChIKey of 6-methyl-3-pentylpyridin-2-amine?
The InChIKey is CBBXOQUNDOJYTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-3-4-5-6-10-8-7-9(2)13-11(10)12/h7-8H,3-6H2,1-2H3,(H2,12,13).
What are the key properties of 6-methyl-3-pentylpyridin-2-amine?
6-methyl-3-pentylpyridin-2-amine has a molecular weight of 178.28 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-pentylpyridin-2-amine is sourced from PubChem (CID 167157111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).