4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine

C12H21N3O — CID 65091866

IUPAC4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine
SMILESCNC(CCCOC)Cc1ccnc(N)c1
InChIInChI=1S/C12H21N3O/c1-14-11(4-3-7-16-2)8-10-5-6-15-12(13)9-10/h5-6,9,11,14H,3-4,7-8H2,1-2H3,(H2,13,15)
InChIKeyHPWCYQZCVDWOQS-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.22
Rot. Bonds7

About 4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine

4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine (PubChem CID 65091866) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine.

Molecular Properties

Compound Name4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine
PubChem CID65091866
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine
SMILESCNC(CCCOC)Cc1ccnc(N)c1
InChIInChI=1S/C12H21N3O/c1-14-11(4-3-7-16-2)8-10-5-6-15-12(13)9-10/h5-6,9,11,14H,3-4,7-8H2,1-2H3,(H2,13,15)
InChIKeyHPWCYQZCVDWOQS-UHFFFAOYSA-N
XLogP1.22
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol
CID 65091967
5-methoxy-N-methyl-1-(4-methylphenyl)pentan-2-amine
CID 62603606
4-[3-methoxy-2-(methylamino)hexyl]pyridin-2-amine
CID 116718992
4-[2-(methylamino)-3-propylsulfanylpropyl]pyridin-2-amine
CID 65129317
5-methoxy-N-methyl-1-(4-propan-2-ylphenyl)pentan-2-amine
CID 65092154
4-(3-ethoxy-2-hydrazinylpropyl)pyridin-2-amine
CID 105235296
4-[4-ethoxy-2-(propylamino)butyl]pyridin-2-amine
CID 106815088
4-[3-(2-fluorophenyl)sulfanyl-2-(methylamino)propyl]pyridin-2-amine
CID 66051154
4-[3-(2-bromophenyl)sulfanyl-2-(methylamino)propyl]pyridin-2-amine
CID 66144269
4-[2-hydrazinyl-3-(3-methylphenyl)propyl]pyridin-2-amine
CID 105208933
5-methoxy-N-methyl-1-(2,4,6-trimethylphenyl)pentan-2-amine
CID 65092092
4-(2-hydrazinylpropyl)pyridin-2-amine
CID 105201271

Frequently Asked Questions

What is the IUPAC name of 4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine?
The IUPAC name of 4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine (CID 65091866) is 4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine.
What is the SMILES notation for 4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine?
The canonical SMILES for 4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine is CNC(CCCOC)Cc1ccnc(N)c1.
What is the InChIKey of 4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine?
The InChIKey is HPWCYQZCVDWOQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-14-11(4-3-7-16-2)8-10-5-6-15-12(13)9-10/h5-6,9,11,14H,3-4,7-8H2,1-2H3,(H2,13,15).
What are the key properties of 4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine?
4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine has a molecular weight of 223.32 g/mol, XLogP of 1.22, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine is sourced from PubChem (CID 65091866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).