3-(furan-2-yl)-N-methylpropan-1-amine

C8H13NO — CID 2772204

IUPAC3-(furan-2-yl)-N-methylpropan-1-amine
SMILESCNCCCc1ccco1
InChIInChI=1S/C8H13NO/c1-9-6-2-4-8-5-3-7-10-8/h3,5,7,9H,2,4,6H2,1H3
InChIKeyGKIUEIPANNQGFU-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.43
Rot. Bonds4

About 3-(furan-2-yl)-N-methylpropan-1-amine

3-(furan-2-yl)-N-methylpropan-1-amine (PubChem CID 2772204) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is 3-(furan-2-yl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-(furan-2-yl)-N-methylpropan-1-amine
PubChem CID2772204
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Name3-(furan-2-yl)-N-methylpropan-1-amine
SMILESCNCCCc1ccco1
InChIInChI=1S/C8H13NO/c1-9-6-2-4-8-5-3-7-10-8/h3,5,7,9H,2,4,6H2,1H3
InChIKeyGKIUEIPANNQGFU-UHFFFAOYSA-N
XLogP1.43
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(furan-2-yl)propyl]formamide
CID 87322197
N-[3-(furan-2-yl)propyl]-4-methoxyaniline;hydrochloride
CID 71444012
N'-[1-(furan-2-yl)propan-2-yl]-N-methylbutane-1,4-diamine
CID 61470742
2-(3-chloropropyl)furan
CID 12549641
3-(furan-2-yl)propane-1-thiol
CID 12549643
4-N-(furan-2-ylmethyl)-1-N,4-N-dimethylpentane-1,4-diamine
CID 62420064
N-[3-(furan-2-yl)propyl]cycloheptanamine
CID 60984430
ethane;2-(3-methoxypropyl)furan
CID 144595726
2-[2-[(furan-2-ylmethylamino)methyl]phenyl]-N-methylethanamine
CID 113425631
11-(furan-2-yl)undecan-1-ol
CID 139763920
N-[3-(furan-2-yl)propyl]-2-(4-methylphenyl)acetamide
CID 53283761
4-ethoxy-N-[3-(furan-2-yl)propyl]benzenesulfonamide
CID 53279766

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-N-methylpropan-1-amine?
The IUPAC name of 3-(furan-2-yl)-N-methylpropan-1-amine (CID 2772204) is 3-(furan-2-yl)-N-methylpropan-1-amine.
What is the SMILES notation for 3-(furan-2-yl)-N-methylpropan-1-amine?
The canonical SMILES for 3-(furan-2-yl)-N-methylpropan-1-amine is CNCCCc1ccco1.
What is the InChIKey of 3-(furan-2-yl)-N-methylpropan-1-amine?
The InChIKey is GKIUEIPANNQGFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-9-6-2-4-8-5-3-7-10-8/h3,5,7,9H,2,4,6H2,1H3.
What are the key properties of 3-(furan-2-yl)-N-methylpropan-1-amine?
3-(furan-2-yl)-N-methylpropan-1-amine has a molecular weight of 139.20 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-N-methylpropan-1-amine is sourced from PubChem (CID 2772204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).