4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine

C15H20N2O — CID 62322509

IUPAC4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine
SMILESCc1cccc(CNC(C)CCc2ccco2)n1
InChIInChI=1S/C15H20N2O/c1-12(8-9-15-7-4-10-18-15)16-11-14-6-3-5-13(2)17-14/h3-7,10,12,16H,8-9,11H2,1-2H3
InChIKeyZIRKYOUMOFWHCQ-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.09
Rot. Bonds6

About 4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine

4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine (PubChem CID 62322509) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine.

Molecular Properties

Compound Name4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine
PubChem CID62322509
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine
SMILESCc1cccc(CNC(C)CCc2ccco2)n1
InChIInChI=1S/C15H20N2O/c1-12(8-9-15-7-4-10-18-15)16-11-14-6-3-5-13(2)17-14/h3-7,10,12,16H,8-9,11H2,1-2H3
InChIKeyZIRKYOUMOFWHCQ-UHFFFAOYSA-N
XLogP3.09
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]butan-2-amine
CID 63985074
4-(furan-2-yl)-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]butan-2-amine
CID 107911508
4-[3-[(6-methyl-2-pyridinyl)methylamino]butyl]phenol
CID 62322123
4-(furan-2-yl)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)butan-2-amine
CID 60695653
N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-(furan-2-yl)butan-2-amine
CID 43644966
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-4-(furan-2-yl)butan-2-amine
CID 78915531
N-[[3-(difluoromethyl)phenyl]methyl]-4-(furan-2-yl)butan-2-amine
CID 115526047
N-but-2-ynyl-4-(furan-2-yl)butan-2-amine
CID 62311547
3-ethyl-N-[4-(furan-2-yl)butan-2-yl]pentan-2-amine
CID 63842275
4-[[4-(furan-2-yl)butan-2-ylamino]methyl]benzene-1,2,3-triol
CID 107730421
4-(furan-2-yl)-N-(thiophen-3-ylmethyl)butan-2-amine
CID 43182405
N-[(3-fluoro-4-methylphenyl)methyl]-4-(furan-2-yl)butan-2-amine
CID 55245951

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine?
The IUPAC name of 4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine (CID 62322509) is 4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine.
What is the SMILES notation for 4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine?
The canonical SMILES for 4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine is Cc1cccc(CNC(C)CCc2ccco2)n1.
What is the InChIKey of 4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine?
The InChIKey is ZIRKYOUMOFWHCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-12(8-9-15-7-4-10-18-15)16-11-14-6-3-5-13(2)17-14/h3-7,10,12,16H,8-9,11H2,1-2H3.
What are the key properties of 4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine?
4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine has a molecular weight of 244.34 g/mol, XLogP of 3.09, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(furan-2-yl)-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine is sourced from PubChem (CID 62322509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).