N-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine

C14H15NO — CID 43177085

IUPACN-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine
SMILESC=CCNC(c1ccccc1)c1ccco1
InChIInChI=1S/C14H15NO/c1-2-10-15-14(13-9-6-11-16-13)12-7-4-3-5-8-12/h2-9,11,14-15H,1,10H2
InChIKeyHVYUDAOMGRMKAN-UHFFFAOYSA-N
MW213.28 g/mol
LogP3.14
Rot. Bonds5

About N-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine

N-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine (PubChem CID 43177085) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is N-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine.

Molecular Properties

Compound NameN-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine
PubChem CID43177085
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC NameN-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine
SMILESC=CCNC(c1ccccc1)c1ccco1
InChIInChI=1S/C14H15NO/c1-2-10-15-14(13-9-6-11-16-13)12-7-4-3-5-8-12/h2-9,11,14-15H,1,10H2
InChIKeyHVYUDAOMGRMKAN-UHFFFAOYSA-N
XLogP3.14
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[furan-2-yl(phenyl)methyl]-2-prop-2-enylsulfanylethanamine
CID 104531327
N-[1-(furan-2-yl)ethyl]prop-2-en-1-amine
CID 43177064
(1R,2S)-2-(benzenesulfonyl)-1-(furan-2-yl)-N-prop-2-enylbut-3-en-1-amine
CID 15527319
1-(furan-2-yl)-1-phenyl-N-(thiophen-3-ylmethyl)methanamine
CID 60669470
3-ethyl-1-[[furan-2-yl(phenyl)methyl]amino]pentan-2-ol
CID 104531149
N-[furan-2-yl(phenyl)methyl]-5-methylsulfanylpentan-1-amine
CID 104926281
2-[[furan-2-yl(phenyl)methyl]amino]-N-methylethanesulfonamide
CID 102675958
(1R)-1-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]ethanamine
CID 81402613
1-cyclobutyl-N-[furan-2-yl(phenyl)methyl]propan-2-amine
CID 115707858
N-[furan-2-yl(phenyl)methyl]-2-morpholin-4-ylethanamine
CID 43178931
N-(furan-2-ylmethyl)-1,1-diphenylmethanamine
CID 15830516
(1R)-1-(furan-2-yl)-N-[(1S)-1-phenylethyl]but-3-en-1-amine
CID 2430998

Frequently Asked Questions

What is the IUPAC name of N-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine?
The IUPAC name of N-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine (CID 43177085) is N-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine.
What is the SMILES notation for N-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine?
The canonical SMILES for N-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine is C=CCNC(c1ccccc1)c1ccco1.
What is the InChIKey of N-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine?
The InChIKey is HVYUDAOMGRMKAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO/c1-2-10-15-14(13-9-6-11-16-13)12-7-4-3-5-8-12/h2-9,11,14-15H,1,10H2.
What are the key properties of N-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine?
N-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine has a molecular weight of 213.28 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[furan-2-yl(phenyl)methyl]prop-2-en-1-amine is sourced from PubChem (CID 43177085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).