N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine

C19H26N2O — CID 112815907

IUPACN-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine
SMILESCCC(NCC(c1ccco1)N1CCCC1)c1ccccc1
InChIInChI=1S/C19H26N2O/c1-2-17(16-9-4-3-5-10-16)20-15-18(19-11-8-14-22-19)21-12-6-7-13-21/h3-5,8-11,14,17-18,20H,2,6-7,12-13,15H2,1H3
InChIKeyFVHAXWYFVBLANH-UHFFFAOYSA-N
MW298.43 g/mol
LogP4.16
Rot. Bonds7

About N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine

N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine (PubChem CID 112815907) has the molecular formula C19H26N2O and a molecular weight of 298.43 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine
PubChem CID112815907
Molecular FormulaC19H26N2O
Molecular Weight298.43 g/mol
Exact Mass298.20
IUPAC NameN-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine
SMILESCCC(NCC(c1ccco1)N1CCCC1)c1ccccc1
InChIInChI=1S/C19H26N2O/c1-2-17(16-9-4-3-5-10-16)20-15-18(19-11-8-14-22-19)21-12-6-7-13-21/h3-5,8-11,14,17-18,20H,2,6-7,12-13,15H2,1H3
InChIKeyFVHAXWYFVBLANH-UHFFFAOYSA-N
XLogP4.16
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]pentan-2-amine
CID 43202553
2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]propanoic acid
CID 66174492
2-(azepan-1-yl)-N-ethyl-2-(furan-2-yl)ethanamine
CID 22692497
(1S)-2-[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol
CID 2106497
2-(furan-2-yl)-N-[1-(3-methylphenyl)ethyl]-2-pyrrolidin-1-ylethanamine
CID 112831610
N-[1-(furan-2-yl)propyl]-3-methyl-2-pyrrolidin-1-ylbutan-1-amine
CID 62634141
2-(furan-2-yl)-N-[1-(1-methylcyclopropyl)ethyl]-2-pyrrolidin-1-ylethanamine
CID 43363213
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2,2-diphenylacetamide;hydrochloride
CID 52984942
2-(diethylamino)-N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-phenylacetamide
CID 56538321
(2R)-2-(dimethylamino)-N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2-phenylacetamide
CID 94956250
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-methyl-3-phenylpentanamide
CID 110312900
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2-methylpropan-1-amine
CID 83380875

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine?
The IUPAC name of N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine (CID 112815907) is N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine.
What is the SMILES notation for N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine?
The canonical SMILES for N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine is CCC(NCC(c1ccco1)N1CCCC1)c1ccccc1.
What is the InChIKey of N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine?
The InChIKey is FVHAXWYFVBLANH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O/c1-2-17(16-9-4-3-5-10-16)20-15-18(19-11-8-14-22-19)21-12-6-7-13-21/h3-5,8-11,14,17-18,20H,2,6-7,12-13,15H2,1H3.
What are the key properties of N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine?
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine has a molecular weight of 298.43 g/mol, XLogP of 4.16, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1-phenylpropan-1-amine is sourced from PubChem (CID 112815907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).