1-(furan-3-yl)-3-methoxyhexan-2-amine

C11H19NO2 — CID 116718509

IUPAC1-(furan-3-yl)-3-methoxyhexan-2-amine
SMILESCCCC(OC)C(N)Cc1ccoc1
InChIInChI=1S/C11H19NO2/c1-3-4-11(13-2)10(12)7-9-5-6-14-8-9/h5-6,8,10-11H,3-4,7,12H2,1-2H3
InChIKeyBKPHQMZTVOXMQE-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.96
Rot. Bonds6

About 1-(furan-3-yl)-3-methoxyhexan-2-amine

1-(furan-3-yl)-3-methoxyhexan-2-amine (PubChem CID 116718509) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-(furan-3-yl)-3-methoxyhexan-2-amine.

Molecular Properties

Compound Name1-(furan-3-yl)-3-methoxyhexan-2-amine
PubChem CID116718509
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name1-(furan-3-yl)-3-methoxyhexan-2-amine
SMILESCCCC(OC)C(N)Cc1ccoc1
InChIInChI=1S/C11H19NO2/c1-3-4-11(13-2)10(12)7-9-5-6-14-8-9/h5-6,8,10-11H,3-4,7,12H2,1-2H3
InChIKeyBKPHQMZTVOXMQE-UHFFFAOYSA-N
XLogP1.96
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(furan-3-yl)-3-methylhexan-2-amine
CID 105029905
3-methoxy-1-(1-methylpyrazol-4-yl)hexan-2-amine
CID 116718521
1-(furan-3-yl)octan-2-amine
CID 105029979
1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine
CID 116715979
4-ethoxy-1-(furan-3-yl)butan-2-amine
CID 105177800
2-(furan-3-ylmethyl)pentanoic acid
CID 12573303
2-(furan-3-yl)-1-(4-methoxyphenyl)ethanamine
CID 83175778
1-(3-ethyl-1-methylpyrazol-5-yl)-3-methoxyhexan-2-amine
CID 116718430
1-(4-ethylphenyl)-3-methoxypentan-2-amine
CID 116715207
N-ethyl-1-(furan-3-yl)-4-methoxybutan-2-amine
CID 83176013
1-(furan-3-yl)-3-methoxy-4-methylpentan-2-ol
CID 116711977
1-(3-bromo-2,6-difluorophenyl)-3-methoxyhexan-2-amine
CID 106268510

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-3-methoxyhexan-2-amine?
The IUPAC name of 1-(furan-3-yl)-3-methoxyhexan-2-amine (CID 116718509) is 1-(furan-3-yl)-3-methoxyhexan-2-amine.
What is the SMILES notation for 1-(furan-3-yl)-3-methoxyhexan-2-amine?
The canonical SMILES for 1-(furan-3-yl)-3-methoxyhexan-2-amine is CCCC(OC)C(N)Cc1ccoc1.
What is the InChIKey of 1-(furan-3-yl)-3-methoxyhexan-2-amine?
The InChIKey is BKPHQMZTVOXMQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-3-4-11(13-2)10(12)7-9-5-6-14-8-9/h5-6,8,10-11H,3-4,7,12H2,1-2H3.
What are the key properties of 1-(furan-3-yl)-3-methoxyhexan-2-amine?
1-(furan-3-yl)-3-methoxyhexan-2-amine has a molecular weight of 197.28 g/mol, XLogP of 1.96, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-3-methoxyhexan-2-amine is sourced from PubChem (CID 116718509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).