N-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine

C15H19NO2 — CID 46736230

IUPACN-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine
SMILESCc1ccc(OC(C)CNCc2ccco2)cc1
InChIInChI=1S/C15H19NO2/c1-12-5-7-14(8-6-12)18-13(2)10-16-11-15-4-3-9-17-15/h3-9,13,16H,10-11H2,1-2H3
InChIKeyINLASZPDVMEHTD-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.15
Rot. Bonds6

About N-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine

N-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine (PubChem CID 46736230) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine
PubChem CID46736230
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC NameN-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine
SMILESCc1ccc(OC(C)CNCc2ccco2)cc1
InChIInChI=1S/C15H19NO2/c1-12-5-7-14(8-6-12)18-13(2)10-16-11-15-4-3-9-17-15/h3-9,13,16H,10-11H2,1-2H3
InChIKeyINLASZPDVMEHTD-UHFFFAOYSA-N
XLogP3.15
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(furan-2-ylmethyl)-2-(2-methylpropoxy)propan-1-amine
CID 62567476
N-(furan-2-ylmethyl)-2-(3-methylbutoxy)propan-1-amine
CID 62565600
N-(furan-2-ylmethyl)-2-(oxetan-3-yloxy)propan-1-amine
CID 102608367
2-but-2-enoxy-N-(furan-2-ylmethyl)propan-1-amine
CID 76946759
2-(cyclopropylmethoxy)-N-(furan-2-ylmethyl)propan-1-amine
CID 62597661
N-(furan-2-ylmethyl)-2-methylbutan-1-amine
CID 43200420
1-N-(furan-2-ylmethyl)-3-methylpentane-1,2-diamine
CID 61150352
1-(furan-2-ylmethyl)-2-methyl-3-(2-phenoxypropyl)guanidine
CID 111179316
N-[4-(furan-2-yl)butan-2-yl]-2-(4-methylphenoxy)propanamide
CID 24641914
2-(2,5-dimethylphenyl)sulfanyl-N-(furan-2-ylmethyl)propan-1-amine
CID 62584859
2-(2,4-dimethylphenyl)sulfanyl-N-(furan-2-ylmethyl)propan-1-amine
CID 62583352
1-N-(furan-2-ylmethyl)-4-methylpentane-1,2-diamine
CID 61150201

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine?
The IUPAC name of N-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine (CID 46736230) is N-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine?
The canonical SMILES for N-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine is Cc1ccc(OC(C)CNCc2ccco2)cc1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine?
The InChIKey is INLASZPDVMEHTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-12-5-7-14(8-6-12)18-13(2)10-16-11-15-4-3-9-17-15/h3-9,13,16H,10-11H2,1-2H3.
What are the key properties of N-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine?
N-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine has a molecular weight of 245.32 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-(4-methylphenoxy)propan-1-amine is sourced from PubChem (CID 46736230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).