[5-(2-methylpropyl)furan-2-yl]methanamine

C9H15NO — CID 83815402

IUPAC[5-(2-methylpropyl)furan-2-yl]methanamine
SMILESCC(C)Cc1ccc(CN)o1
InChIInChI=1S/C9H15NO/c1-7(2)5-8-3-4-9(6-10)11-8/h3-4,7H,5-6,10H2,1-2H3
InChIKeyZDNCJDNLDCULOJ-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.94
Rot. Bonds3

About [5-(2-methylpropyl)furan-2-yl]methanamine

[5-(2-methylpropyl)furan-2-yl]methanamine (PubChem CID 83815402) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is [5-(2-methylpropyl)furan-2-yl]methanamine.

Molecular Properties

Compound Name[5-(2-methylpropyl)furan-2-yl]methanamine
PubChem CID83815402
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name[5-(2-methylpropyl)furan-2-yl]methanamine
SMILESCC(C)Cc1ccc(CN)o1
InChIInChI=1S/C9H15NO/c1-7(2)5-8-3-4-9(6-10)11-8/h3-4,7H,5-6,10H2,1-2H3
InChIKeyZDNCJDNLDCULOJ-UHFFFAOYSA-N
XLogP1.94
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[5-(propan-2-yloxymethyl)furan-2-yl]methanamine
CID 62457675
2-fluoropropane;(5-methylfuran-2-yl)methanamine
CID 142882995
1-[5-(aminomethyl)furan-2-yl]-N,N-dimethylethanamine
CID 105433888
2-ethenyl-5-(2-methylpropyl)furan
CID 71428400
1-[5-(aminomethyl)furan-2-yl]-N,N-diethylethanamine
CID 105450223
5-(aminomethyl)-N-methyl-N-propan-2-ylfuran-2-amine
CID 82503110
[2-(2-methylpropyl)-1-benzofuran-6-yl]methanamine
CID 84671699
[5-[1-[5-(aminomethyl)furan-2-yl]butyl]furan-2-yl]methanamine
CID 10243742
[2-(2-methylpropyl)furan-3-yl]methanamine
CID 82416814
5-(aminomethyl)-N,N-dimethylfuran-2-amine
CID 82418188
N-[[5-(aminomethyl)furan-2-yl]methyl]-N-propan-2-ylpentan-1-amine
CID 62462162
[5-[(2-propan-2-ylphenoxy)methyl]furan-2-yl]methanamine
CID 62458746

Frequently Asked Questions

What is the IUPAC name of [5-(2-methylpropyl)furan-2-yl]methanamine?
The IUPAC name of [5-(2-methylpropyl)furan-2-yl]methanamine (CID 83815402) is [5-(2-methylpropyl)furan-2-yl]methanamine.
What is the SMILES notation for [5-(2-methylpropyl)furan-2-yl]methanamine?
The canonical SMILES for [5-(2-methylpropyl)furan-2-yl]methanamine is CC(C)Cc1ccc(CN)o1.
What is the InChIKey of [5-(2-methylpropyl)furan-2-yl]methanamine?
The InChIKey is ZDNCJDNLDCULOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-7(2)5-8-3-4-9(6-10)11-8/h3-4,7H,5-6,10H2,1-2H3.
What are the key properties of [5-(2-methylpropyl)furan-2-yl]methanamine?
[5-(2-methylpropyl)furan-2-yl]methanamine has a molecular weight of 153.22 g/mol, XLogP of 1.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-methylpropyl)furan-2-yl]methanamine is sourced from PubChem (CID 83815402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).