1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine

C16H22N2O — CID 66448009

IUPAC1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine
SMILESCCCNC(c1ccoc1C)C(C)c1ccccn1
InChIInChI=1S/C16H22N2O/c1-4-9-18-16(14-8-11-19-13(14)3)12(2)15-7-5-6-10-17-15/h5-8,10-12,16,18H,4,9H2,1-3H3
InChIKeyNXCFMNWLFONXEK-UHFFFAOYSA-N
MW258.37 g/mol
LogP3.83
Rot. Bonds6

About 1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine

1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine (PubChem CID 66448009) has the molecular formula C16H22N2O and a molecular weight of 258.37 g/mol. Its IUPAC name is 1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound Name1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine
PubChem CID66448009
Molecular FormulaC16H22N2O
Molecular Weight258.37 g/mol
Exact Mass258.17
IUPAC Name1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine
SMILESCCCNC(c1ccoc1C)C(C)c1ccccn1
InChIInChI=1S/C16H22N2O/c1-4-9-18-16(14-8-11-19-13(14)3)12(2)15-7-5-6-10-17-15/h5-8,10-12,16,18H,4,9H2,1-3H3
InChIKeyNXCFMNWLFONXEK-UHFFFAOYSA-N
XLogP3.83
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine
CID 66446839
1-(2-bromo-5-methylphenyl)-N-propyl-2-pyridin-2-ylpropan-1-amine
CID 81112033
N-propyl-2-pyridin-2-yl-1-pyridin-4-ylpropan-1-amine
CID 66447627
1-(2-bromofuran-3-yl)-N-ethyl-2-pyridin-2-ylpropan-1-amine
CID 106854819
1-(2-bromo-5-fluorophenyl)-N-propyl-2-pyridin-2-ylpropan-1-amine
CID 66447432
N,4-dipropyl-2-pyridin-2-ylheptan-3-amine
CID 82987036
1-(3,4-difluorophenyl)-N-propyl-2-pyridin-2-ylpropan-1-amine
CID 66447426
N-ethyl-1-(2-fluorophenyl)-2-pyridin-2-ylpropan-1-amine
CID 66447023
2,2-difluoro-N-propyl-4-pyridin-2-ylpentan-3-amine
CID 114249556
5,5-dimethyl-N-propyl-2-pyridin-2-ylhexan-3-amine
CID 66447424
1-(2-bromophenyl)-N-ethyl-2-pyridin-2-ylpropan-1-amine
CID 66446447
1-(2,3-difluorophenyl)-N-ethyl-2-pyridin-2-ylpropan-1-amine
CID 66447218

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine?
The IUPAC name of 1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine (CID 66448009) is 1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for 1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine?
The canonical SMILES for 1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine is CCCNC(c1ccoc1C)C(C)c1ccccn1.
What is the InChIKey of 1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine?
The InChIKey is NXCFMNWLFONXEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-4-9-18-16(14-8-11-19-13(14)3)12(2)15-7-5-6-10-17-15/h5-8,10-12,16,18H,4,9H2,1-3H3.
What are the key properties of 1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine?
1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine has a molecular weight of 258.37 g/mol, XLogP of 3.83, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 66448009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).