N-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine

C18H25NO — CID 79421182

IUPACN-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine
SMILESCc1ccccc1C(CNC(C)(C)C)Cc1ccco1
InChIInChI=1S/C18H25NO/c1-14-8-5-6-10-17(14)15(13-19-18(2,3)4)12-16-9-7-11-20-16/h5-11,15,19H,12-13H2,1-4H3
InChIKeyUTYFSAUOKCCUKR-UHFFFAOYSA-N
MW271.40 g/mol
LogP4.30
Rot. Bonds5

About N-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine

N-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine (PubChem CID 79421182) has the molecular formula C18H25NO and a molecular weight of 271.40 g/mol. Its IUPAC name is N-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine
PubChem CID79421182
Molecular FormulaC18H25NO
Molecular Weight271.40 g/mol
Exact Mass271.19
IUPAC NameN-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine
SMILESCc1ccccc1C(CNC(C)(C)C)Cc1ccco1
InChIInChI=1S/C18H25NO/c1-14-8-5-6-10-17(14)15(13-19-18(2,3)4)12-16-9-7-11-20-16/h5-11,15,19H,12-13H2,1-4H3
InChIKeyUTYFSAUOKCCUKR-UHFFFAOYSA-N
XLogP4.30
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-bromophenyl)-3-(furan-2-yl)propyl]-2-methylpropan-2-amine
CID 79448849
3-(furan-2-yl)-N-methyl-2-(2-methylphenyl)propan-1-amine
CID 79420846
N-[3-(furan-2-yl)-2-(3-methylphenyl)propyl]-2-methylpropan-2-amine
CID 79416841
N-[2-(4-chlorophenyl)-3-(furan-2-yl)propyl]-2-methylpropan-2-amine
CID 79437864
N-tert-butyl-2-(2-methylphenyl)pentan-1-amine
CID 79420694
N-tert-butyl-4-methyl-2-(2-methylphenyl)pentan-1-amine
CID 79421586
N-[3-(5-bromothiophen-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine
CID 79424142
2-methyl-N-[2-(2-methylphenyl)-3-(1,3-thiazol-5-yl)propyl]propan-2-amine
CID 115979445
N-[2-(3-bromophenyl)-3-(furan-2-yl)propyl]-2-methylpropan-2-amine
CID 79442534
N-tert-butyl-2-(furan-2-ylmethyl)pentan-1-amine
CID 62998488
2-methyl-N-[2-(2-methylphenyl)-3-(1-methylpyrazol-3-yl)propyl]propan-2-amine
CID 82870120
2-(2-fluorophenyl)-3-(furan-2-yl)-N-propan-2-ylpropan-1-amine
CID 79439686

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine?
The IUPAC name of N-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine (CID 79421182) is N-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine is Cc1ccccc1C(CNC(C)(C)C)Cc1ccco1.
What is the InChIKey of N-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine?
The InChIKey is UTYFSAUOKCCUKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NO/c1-14-8-5-6-10-17(14)15(13-19-18(2,3)4)12-16-9-7-11-20-16/h5-11,15,19H,12-13H2,1-4H3.
What are the key properties of N-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine?
N-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine has a molecular weight of 271.40 g/mol, XLogP of 4.30, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-yl)-2-(2-methylphenyl)propyl]-2-methylpropan-2-amine is sourced from PubChem (CID 79421182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).