ethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine

C10H19NO — CID 142856729

IUPACethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine
SMILESCC.CC[C@@H](N)c1ccc(C)o1
InChIInChI=1S/C8H13NO.C2H6/c1-3-7(9)8-5-4-6(2)10-8;1-2/h4-5,7H,3,9H2,1-2H3;1-2H3/t7-;/m1./s1
InChIKeyMZUXMVIODOFFGG-OGFXRTJISA-N
MW169.27 g/mol
LogP3.02
Rot. Bonds2

About ethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine

ethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine (PubChem CID 142856729) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is ethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine.

Molecular Properties

Compound Nameethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine
PubChem CID142856729
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Nameethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine
SMILESCC.CC[C@@H](N)c1ccc(C)o1
InChIInChI=1S/C8H13NO.C2H6/c1-3-7(9)8-5-4-6(2)10-8;1-2/h4-5,7H,3,9H2,1-2H3;1-2H3/t7-;/m1./s1
InChIKeyMZUXMVIODOFFGG-OGFXRTJISA-N
XLogP3.02
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethoxy-1-(5-methylfuran-2-yl)ethanamine
CID 16793106
3-methyl-1-(5-methylfuran-2-yl)pentan-1-amine
CID 114874408
1-(5-methylfuran-2-yl)hexan-1-amine;hydrochloride
CID 86262852
(1S)-2-fluoro-1-(5-methylfuran-2-yl)ethanamine;hydrochloride
CID 171212357
(1S)-4,4,4-trifluoro-1-(5-methylfuran-2-yl)butan-1-amine
CID 171231975
(1S)-1-(5-methylfuran-2-yl)pentane-1,5-diamine
CID 171231965
(1R)-4,4,4-trifluoro-1-(5-methylfuran-2-yl)butan-1-amine
CID 171212372
N'-methyl-1-(5-methylfuran-2-yl)butane-1,4-diamine
CID 116933940
4-amino-4-(5-methylfuran-2-yl)butanenitrile
CID 116940083
(1S)-1-(5-chlorofuran-2-yl)propan-1-amine
CID 131197963
5-[(1S)-1-aminopropyl]furan-2-ol
CID 130706331
3-amino-3-(5-methylfuran-2-yl)propanenitrile
CID 55292038

Frequently Asked Questions

What is the IUPAC name of ethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine?
The IUPAC name of ethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine (CID 142856729) is ethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine.
What is the SMILES notation for ethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine?
The canonical SMILES for ethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine is CC.CC[C@@H](N)c1ccc(C)o1.
What is the InChIKey of ethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine?
The InChIKey is MZUXMVIODOFFGG-OGFXRTJISA-N. The full InChI is InChI=1S/C8H13NO.C2H6/c1-3-7(9)8-5-4-6(2)10-8;1-2/h4-5,7H,3,9H2,1-2H3;1-2H3/t7-;/m1./s1.
What are the key properties of ethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine?
ethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine has a molecular weight of 169.27 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine is sourced from PubChem (CID 142856729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).