2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine

C12H20N2O — CID 83820490

IUPAC2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine
SMILESCN1CCC(c2ccc(CCN)o2)CC1
InChIInChI=1S/C12H20N2O/c1-14-8-5-10(6-9-14)12-3-2-11(15-12)4-7-13/h2-3,10H,4-9,13H2,1H3
InChIKeyKXBNSEQQISTCBX-UHFFFAOYSA-N
MW208.30 g/mol
LogP1.59
Rot. Bonds3

About 2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine

2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine (PubChem CID 83820490) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine.

Molecular Properties

Compound Name2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine
PubChem CID83820490
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine
SMILESCN1CCC(c2ccc(CCN)o2)CC1
InChIInChI=1S/C12H20N2O/c1-14-8-5-10(6-9-14)12-3-2-11(15-12)4-7-13/h2-3,10H,4-9,13H2,1H3
InChIKeyKXBNSEQQISTCBX-UHFFFAOYSA-N
XLogP1.59
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-(4-methylcyclohexyl)furan-2-yl]ethanamine
CID 83833926
[5-(1-methylpiperidin-4-yl)-1,3,4-oxadiazol-2-yl]methanamine
CID 71778174
3-(5-cyclopentylfuran-2-yl)propanoic acid
CID 83820418
4-(1-methylpiperidin-4-yl)benzene-1,3-diamine
CID 142507693
3-[3-(1-methylpiperidin-4-yl)phenyl]propan-1-amine
CID 117337018
2-[4-(1-methylpiperidin-4-yl)phenoxy]ethanamine
CID 115040366
4-(4,7-dimethyl-1-benzofuran-2-yl)-1-methylpiperidine
CID 23312283
2-[5-methyl-4-(1-methylpyrrolidin-3-yl)-1,3-oxazol-2-yl]ethanamine
CID 115026533
2-[4-(1-methylpyrrolidin-3-yl)-1,3-oxazol-2-yl]ethanamine
CID 115020306
3-[4-(1-methylpyrrolidin-3-yl)phenyl]propan-1-amine
CID 84786356
3-N-[5-(1-methylpiperidin-4-yl)pyrimidin-2-yl]butane-1,3-diamine
CID 116974501
2-cyclopropyl-4-(1-methylpiperidin-4-yl)aniline
CID 168888643

Frequently Asked Questions

What is the IUPAC name of 2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine?
The IUPAC name of 2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine (CID 83820490) is 2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine.
What is the SMILES notation for 2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine?
The canonical SMILES for 2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine is CN1CCC(c2ccc(CCN)o2)CC1.
What is the InChIKey of 2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine?
The InChIKey is KXBNSEQQISTCBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-14-8-5-10(6-9-14)12-3-2-11(15-12)4-7-13/h2-3,10H,4-9,13H2,1H3.
What are the key properties of 2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine?
2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine has a molecular weight of 208.30 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(1-methylpiperidin-4-yl)furan-2-yl]ethanamine is sourced from PubChem (CID 83820490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).