2-(pyridin-3-yloxymethyl)pentan-1-amine

C11H18N2O — CID 117241997

IUPAC2-(pyridin-3-yloxymethyl)pentan-1-amine
SMILESCCCC(CN)COc1cccnc1
InChIInChI=1S/C11H18N2O/c1-2-4-10(7-12)9-14-11-5-3-6-13-8-11/h3,5-6,8,10H,2,4,7,9,12H2,1H3
InChIKeyFNHVFQZYHAJYRN-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.84
Rot. Bonds6

About 2-(pyridin-3-yloxymethyl)pentan-1-amine

2-(pyridin-3-yloxymethyl)pentan-1-amine (PubChem CID 117241997) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-(pyridin-3-yloxymethyl)pentan-1-amine.

Molecular Properties

Compound Name2-(pyridin-3-yloxymethyl)pentan-1-amine
PubChem CID117241997
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name2-(pyridin-3-yloxymethyl)pentan-1-amine
SMILESCCCC(CN)COc1cccnc1
InChIInChI=1S/C11H18N2O/c1-2-4-10(7-12)9-14-11-5-3-6-13-8-11/h3,5-6,8,10H,2,4,7,9,12H2,1H3
InChIKeyFNHVFQZYHAJYRN-UHFFFAOYSA-N
XLogP1.84
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(aminomethyl)-4-pyridin-3-yloxybutan-1-ol
CID 117236929
1-pyridin-3-yloxypentan-2-amine
CID 117241763
3,3-dimethyl-1-pyridin-3-yloxybutan-2-amine
CID 117242309
4-methoxy-1-pyridin-3-yloxybutan-2-amine
CID 117236788
2-(2-methoxyphenyl)-3-pyridin-3-yloxypropan-1-amine
CID 117244112
[3-(2-propylpentoxy)phenyl]methanamine
CID 58027597
3-octadecoxypyridine
CID 175800212
N-(2-pyridin-3-yloxyethyl)hexan-3-amine
CID 115905779
1-(2-bromophenyl)-2-pyridin-3-yloxyethanamine
CID 117243775
(2R)-2-methyl-3-[3-(2-propylpentoxy)phenyl]propan-1-amine
CID 126619606
1-(3-methoxyphenyl)-2-pyridin-3-yloxyethanamine
CID 117242794
1-bromo-3-(2-propylpentoxy)benzene
CID 67316784

Frequently Asked Questions

What is the IUPAC name of 2-(pyridin-3-yloxymethyl)pentan-1-amine?
The IUPAC name of 2-(pyridin-3-yloxymethyl)pentan-1-amine (CID 117241997) is 2-(pyridin-3-yloxymethyl)pentan-1-amine.
What is the SMILES notation for 2-(pyridin-3-yloxymethyl)pentan-1-amine?
The canonical SMILES for 2-(pyridin-3-yloxymethyl)pentan-1-amine is CCCC(CN)COc1cccnc1.
What is the InChIKey of 2-(pyridin-3-yloxymethyl)pentan-1-amine?
The InChIKey is FNHVFQZYHAJYRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-2-4-10(7-12)9-14-11-5-3-6-13-8-11/h3,5-6,8,10H,2,4,7,9,12H2,1H3.
What are the key properties of 2-(pyridin-3-yloxymethyl)pentan-1-amine?
2-(pyridin-3-yloxymethyl)pentan-1-amine has a molecular weight of 194.28 g/mol, XLogP of 1.84, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyridin-3-yloxymethyl)pentan-1-amine is sourced from PubChem (CID 117241997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).