1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine

C14H15NO — CID 10465809

IUPAC1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine
SMILESC[C@@H](Cc1ccccc1)/N=C/c1ccco1
InChIInChI=1S/C14H15NO/c1-12(10-13-6-3-2-4-7-13)15-11-14-8-5-9-16-14/h2-9,11-12H,10H2,1H3/b15-11+/t12-/m0/s1
InChIKeySFJVXBULNQFKBT-YGRGUWMTSA-N
MW213.28 g/mol
LogP3.33
Rot. Bonds4

About 1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine

1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine (PubChem CID 10465809) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is 1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine.

Molecular Properties

Compound Name1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine
PubChem CID10465809
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC Name1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine
SMILESC[C@@H](Cc1ccccc1)/N=C/c1ccco1
InChIInChI=1S/C14H15NO/c1-12(10-13-6-3-2-4-7-13)15-11-14-8-5-9-16-14/h2-9,11-12H,10H2,1H3/b15-11+/t12-/m0/s1
InChIKeySFJVXBULNQFKBT-YGRGUWMTSA-N
XLogP3.33
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

5-phenyl-3-[[(2S)-1-phenylpropan-2-yl]iminomethyl]furan-2-ol
CID 768819
ethane;1-(furan-2-yl)-N-phenylmethanimine
CID 160534475
N-[(E)-furan-2-ylmethylideneamino]-2-[4-(2-methylpropyl)phenyl]propanamide
CID 75202374
(E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine
CID 46707076
1-(furan-2-yl)-N-[2-(furan-2-ylmethylideneamino)phenyl]methanimine
CID 10015655
N,N'-bis(1-phenylpropan-2-yl)methanediimine
CID 3704369
(E)-1-(furan-2-yl)-N-trimethylsilylmethanimine
CID 10630921
ethane;2-methylpropylbenzene
CID 162200929
(NE)-N-(furan-2-ylmethylidene)propane-2-sulfinamide
CID 177399008
2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-3-phenylpropanoic acid
CID 6188146
1-(furan-2-yl)-N-oxidomethanimine
CID 135527449
1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine
CID 13128411

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine?
The IUPAC name of 1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine (CID 10465809) is 1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine.
What is the SMILES notation for 1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine?
The canonical SMILES for 1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine is C[C@@H](Cc1ccccc1)/N=C/c1ccco1.
What is the InChIKey of 1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine?
The InChIKey is SFJVXBULNQFKBT-YGRGUWMTSA-N. The full InChI is InChI=1S/C14H15NO/c1-12(10-13-6-3-2-4-7-13)15-11-14-8-5-9-16-14/h2-9,11-12H,10H2,1H3/b15-11+/t12-/m0/s1.
What are the key properties of 1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine?
1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine has a molecular weight of 213.28 g/mol, XLogP of 3.33, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine is sourced from PubChem (CID 10465809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).