4-(2-methoxyphenoxy)pentan-1-amine

C12H19NO2 — CID 62460101

IUPAC4-(2-methoxyphenoxy)pentan-1-amine
SMILESCOc1ccccc1OC(C)CCCN
InChIInChI=1S/C12H19NO2/c1-10(6-5-9-13)15-12-8-4-3-7-11(12)14-2/h3-4,7-8,10H,5-6,9,13H2,1-2H3
InChIKeyIVBLNPMXHPSCPF-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.20
Rot. Bonds6

About 4-(2-methoxyphenoxy)pentan-1-amine

4-(2-methoxyphenoxy)pentan-1-amine (PubChem CID 62460101) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 4-(2-methoxyphenoxy)pentan-1-amine.

Molecular Properties

Compound Name4-(2-methoxyphenoxy)pentan-1-amine
PubChem CID62460101
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name4-(2-methoxyphenoxy)pentan-1-amine
SMILESCOc1ccccc1OC(C)CCCN
InChIInChI=1S/C12H19NO2/c1-10(6-5-9-13)15-12-8-4-3-7-11(12)14-2/h3-4,7-8,10H,5-6,9,13H2,1-2H3
InChIKeyIVBLNPMXHPSCPF-UHFFFAOYSA-N
XLogP2.20
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-prop-1-enylphenoxy)pentan-1-amine
CID 76943605
3-(2,3-dimethoxyphenoxy)butan-1-amine
CID 112508081
(1S)-1-(2-methoxyphenyl)butane-1,4-diamine;hydrochloride
CID 171219977
5-amino-1-(2-methoxyphenyl)-2-methylpentan-1-one
CID 116613631
2-methoxy-6-octan-2-yloxyaniline
CID 113392822
4-(2,4-dichlorophenoxy)pentan-1-amine
CID 62461001
4-naphthalen-2-yloxypentan-1-amine
CID 55076664
5-[2-(benzenesulfonyl)phenoxy]hexan-1-amine
CID 57046535
4-(4-bromo-2-methylphenoxy)pentan-1-amine
CID 63217030
1-fluoro-2-[(2R)-heptan-2-yl]oxybenzene
CID 14766294
1,2-dimethoxy-4-[2-(2-methoxyphenoxy)propyl]benzene
CID 57481807
5-methoxy-4-N-[(1S)-1-(2-methoxyphenyl)ethyl]pentane-1,4-diamine
CID 103390524

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenoxy)pentan-1-amine?
The IUPAC name of 4-(2-methoxyphenoxy)pentan-1-amine (CID 62460101) is 4-(2-methoxyphenoxy)pentan-1-amine.
What is the SMILES notation for 4-(2-methoxyphenoxy)pentan-1-amine?
The canonical SMILES for 4-(2-methoxyphenoxy)pentan-1-amine is COc1ccccc1OC(C)CCCN.
What is the InChIKey of 4-(2-methoxyphenoxy)pentan-1-amine?
The InChIKey is IVBLNPMXHPSCPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-10(6-5-9-13)15-12-8-4-3-7-11(12)14-2/h3-4,7-8,10H,5-6,9,13H2,1-2H3.
What are the key properties of 4-(2-methoxyphenoxy)pentan-1-amine?
4-(2-methoxyphenoxy)pentan-1-amine has a molecular weight of 209.29 g/mol, XLogP of 2.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenoxy)pentan-1-amine is sourced from PubChem (CID 62460101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).