4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine

C15H20N2O — CID 43205350

IUPAC4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine
SMILESCC(CCc1ccco1)NC(C)c1ccccn1
InChIInChI=1S/C15H20N2O/c1-12(8-9-14-6-5-11-18-14)17-13(2)15-7-3-4-10-16-15/h3-7,10-13,17H,8-9H2,1-2H3
InChIKeyXSGORLUOIWOAMN-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.35
Rot. Bonds6

About 4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine

4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine (PubChem CID 43205350) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine.

Molecular Properties

Compound Name4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine
PubChem CID43205350
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine
SMILESCC(CCc1ccco1)NC(C)c1ccccn1
InChIInChI=1S/C15H20N2O/c1-12(8-9-14-6-5-11-18-14)17-13(2)15-7-3-4-10-16-15/h3-7,10-13,17H,8-9H2,1-2H3
InChIKeyXSGORLUOIWOAMN-UHFFFAOYSA-N
XLogP3.35
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 ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(furan-2-yl)-N-(1-phenylethyl)butan-2-amine
CID 43182410
N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine
CID 81401489
N-(furan-2-ylmethyl)-2-(1-pyridin-2-ylethylamino)propanamide
CID 43396718
N-(furan-2-ylmethyl)-2-[[(1S)-1-pyridin-2-ylethyl]amino]propanamide
CID 81401992
4-[3-(1-pyridin-2-ylethylamino)butyl]phenol
CID 43202604
2-[1-[4-(furan-2-yl)butan-2-ylamino]ethyl]phenol
CID 43205349
4-(furan-2-yl)-N-[(1S)-1-(2-methylphenyl)ethyl]butan-2-amine
CID 81374293
(2S)-N-[(1S)-1-pyridin-2-ylethyl]hex-5-en-2-amine
CID 97358759
4-(furan-2-yl)-N-[(1S)-1-(4-methylphenyl)ethyl]butan-2-amine
CID 81349893
4-(furan-2-yl)-N-[(1R)-1-(4-methylphenyl)ethyl]butan-2-amine
CID 81349155
N-[(1S)-1-(4-chlorophenyl)ethyl]-4-(furan-2-yl)butan-2-amine
CID 81352630
N-[4-(furan-2-yl)butan-2-yl]-2-methyl-1-phenylpropan-1-amine
CID 43685449

Frequently Asked Questions

What is the IUPAC name of 4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine?
The IUPAC name of 4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine (CID 43205350) is 4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine.
What is the SMILES notation for 4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine?
The canonical SMILES for 4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine is CC(CCc1ccco1)NC(C)c1ccccn1.
What is the InChIKey of 4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine?
The InChIKey is XSGORLUOIWOAMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-12(8-9-14-6-5-11-18-14)17-13(2)15-7-3-4-10-16-15/h3-7,10-13,17H,8-9H2,1-2H3.
What are the key properties of 4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine?
4-(furan-2-yl)-N-(1-pyridin-2-ylethyl)butan-2-amine has a molecular weight of 244.34 g/mol, XLogP of 3.35, 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-(1-pyridin-2-ylethyl)butan-2-amine is sourced from PubChem (CID 43205350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).