N-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine

C18H26N2O — CID 66446839

IUPACN-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine
SMILESCCCNC(c1c(C)oc(C)c1C)C(C)c1ccccn1
InChIInChI=1S/C18H26N2O/c1-6-10-20-18(13(3)16-9-7-8-11-19-16)17-12(2)14(4)21-15(17)5/h7-9,11,13,18,20H,6,10H2,1-5H3
InChIKeyJNBADFFTWPIHJL-UHFFFAOYSA-N
MW286.42 g/mol
LogP4.44
Rot. Bonds6

About N-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine

N-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine (PubChem CID 66446839) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine.

Molecular Properties

Compound NameN-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine
PubChem CID66446839
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine
SMILESCCCNC(c1c(C)oc(C)c1C)C(C)c1ccccn1
InChIInChI=1S/C18H26N2O/c1-6-10-20-18(13(3)16-9-7-8-11-19-16)17-12(2)14(4)21-15(17)5/h7-9,11,13,18,20H,6,10H2,1-5H3
InChIKeyJNBADFFTWPIHJL-UHFFFAOYSA-N
XLogP4.44
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methylfuran-3-yl)-N-propyl-2-pyridin-2-ylpropan-1-amine
CID 66448009
N-propyl-2-pyridin-2-yl-1-pyridin-4-ylpropan-1-amine
CID 66447627
1-(2-bromo-5-methylphenyl)-N-propyl-2-pyridin-2-ylpropan-1-amine
CID 81112033
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
1-(2-bromo-5-fluorophenyl)-N-propyl-2-pyridin-2-ylpropan-1-amine
CID 66447432
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-(2,6-dichlorophenyl)-N-ethyl-2-pyridin-2-ylpropan-1-amine
CID 66446048
1-(2-bromofuran-3-yl)-N-ethyl-2-pyridin-2-ylpropan-1-amine
CID 106854819
1-(2-methylcyclopentyl)-N-propyl-2-pyridin-2-ylpropan-1-amine
CID 107179902
1-(oxolan-2-yl)-N-propyl-3-pyridin-2-ylbutan-2-amine
CID 66446842

Frequently Asked Questions

What is the IUPAC name of N-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine?
The IUPAC name of N-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine (CID 66446839) is N-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine.
What is the SMILES notation for N-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine?
The canonical SMILES for N-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine is CCCNC(c1c(C)oc(C)c1C)C(C)c1ccccn1.
What is the InChIKey of N-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine?
The InChIKey is JNBADFFTWPIHJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-6-10-20-18(13(3)16-9-7-8-11-19-16)17-12(2)14(4)21-15(17)5/h7-9,11,13,18,20H,6,10H2,1-5H3.
What are the key properties of N-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine?
N-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine has a molecular weight of 286.42 g/mol, XLogP of 4.44, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-2-pyridin-2-yl-1-(2,4,5-trimethylfuran-3-yl)propan-1-amine is sourced from PubChem (CID 66446839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).