4-methoxy-1-pyridin-3-ylpentan-1-amine

C11H18N2O — CID 105098535

IUPAC4-methoxy-1-pyridin-3-ylpentan-1-amine
SMILESCOC(C)CCC(N)c1cccnc1
InChIInChI=1S/C11H18N2O/c1-9(14-2)5-6-11(12)10-4-3-7-13-8-10/h3-4,7-9,11H,5-6,12H2,1-2H3
InChIKeyJALIRBCMGHWUIM-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.90
Rot. Bonds5

About 4-methoxy-1-pyridin-3-ylpentan-1-amine

4-methoxy-1-pyridin-3-ylpentan-1-amine (PubChem CID 105098535) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 4-methoxy-1-pyridin-3-ylpentan-1-amine.

Molecular Properties

Compound Name4-methoxy-1-pyridin-3-ylpentan-1-amine
PubChem CID105098535
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name4-methoxy-1-pyridin-3-ylpentan-1-amine
SMILESCOC(C)CCC(N)c1cccnc1
InChIInChI=1S/C11H18N2O/c1-9(14-2)5-6-11(12)10-4-3-7-13-8-10/h3-4,7-9,11H,5-6,12H2,1-2H3
InChIKeyJALIRBCMGHWUIM-UHFFFAOYSA-N
XLogP1.90
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-pyridin-3-ylpropane-1,3-diamine
CID 116932848
(1R)-3-fluoro-1-pyridin-3-ylpropan-1-amine;hydrochloride
CID 171201508
4-propan-2-yloxy-1-pyridin-3-ylbutan-1-amine
CID 21156680
(1S)-1-pyridin-3-ylhexan-1-amine
CID 94506966
methyl (5S)-5-amino-5-pyridin-3-ylpentanoate
CID 52951908
(4R)-4-amino-4-pyridin-3-ylbutan-1-ol
CID 15886729
4-amino-4-pyridin-3-ylbutan-1-ol
CID 85412290
3-methylsulfonyl-1-pyridin-3-ylpropan-1-amine
CID 62602759
(1S)-1-pyridin-3-ylpentane-1,5-diamine;hydrochloride
CID 171221036
3-methyl-1-pyridin-3-ylbutane-1,4-diamine
CID 116934246
2-amino-2-pyridin-3-ylethanol
CID 2734590
(1S)-2-methyl-1-pyridin-3-ylbutan-1-amine
CID 130856661

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-pyridin-3-ylpentan-1-amine?
The IUPAC name of 4-methoxy-1-pyridin-3-ylpentan-1-amine (CID 105098535) is 4-methoxy-1-pyridin-3-ylpentan-1-amine.
What is the SMILES notation for 4-methoxy-1-pyridin-3-ylpentan-1-amine?
The canonical SMILES for 4-methoxy-1-pyridin-3-ylpentan-1-amine is COC(C)CCC(N)c1cccnc1.
What is the InChIKey of 4-methoxy-1-pyridin-3-ylpentan-1-amine?
The InChIKey is JALIRBCMGHWUIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-9(14-2)5-6-11(12)10-4-3-7-13-8-10/h3-4,7-9,11H,5-6,12H2,1-2H3.
What are the key properties of 4-methoxy-1-pyridin-3-ylpentan-1-amine?
4-methoxy-1-pyridin-3-ylpentan-1-amine has a molecular weight of 194.28 g/mol, XLogP of 1.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-pyridin-3-ylpentan-1-amine is sourced from PubChem (CID 105098535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).