N-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine

C13H16N2O — CID 103625236

IUPACN-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine
SMILESCC(C)NCc1ccc(-c2cccnc2)o1
InChIInChI=1S/C13H16N2O/c1-10(2)15-9-12-5-6-13(16-12)11-4-3-7-14-8-11/h3-8,10,15H,9H2,1-2H3
InChIKeyVQVGAFBVPMTIOP-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.84
Rot. Bonds4

About N-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine

N-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine (PubChem CID 103625236) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is N-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine
PubChem CID103625236
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC NameN-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine
SMILESCC(C)NCc1ccc(-c2cccnc2)o1
InChIInChI=1S/C13H16N2O/c1-10(2)15-9-12-5-6-13(16-12)11-4-3-7-14-8-11/h3-8,10,15H,9H2,1-2H3
InChIKeyVQVGAFBVPMTIOP-UHFFFAOYSA-N
XLogP2.84
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-pyrazin-2-ylfuran-2-yl)methyl]propan-2-amine
CID 106887323
N-[(5-quinoxalin-6-ylfuran-2-yl)methyl]propan-2-amine
CID 60961490
N-[[5-[4-(trifluoromethyl)-3-pyridinyl]furan-2-yl]methyl]propan-2-amine
CID 106888255
N-[[5-[3-(trifluoromethyl)phenyl]furan-2-yl]methyl]propan-2-amine;hydrochloride
CID 17156683
N-[(4-pyridin-3-ylphenyl)methyl]propan-2-amine
CID 54911631
N-[[5-(2-methylpyrazol-3-yl)furan-2-yl]methyl]propan-2-amine
CID 106887263
N-[[5-[4-(2-methylpropyl)phenyl]furan-2-yl]methyl]propan-2-amine
CID 106888608
N-[[5-(4-bromo-3,5-dimethylphenyl)furan-2-yl]methyl]propan-2-amine
CID 107577096
1-[4-[5-[(propan-2-ylamino)methyl]furan-2-yl]phenyl]ethanol;hydrochloride
CID 17156433
N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]propan-2-amine
CID 60708436
N-[[5-(4-butylphenyl)furan-2-yl]methyl]propan-2-amine
CID 43624940
N-[[5-(4-bromo-3-fluorophenyl)furan-2-yl]methyl]propan-2-amine
CID 65435627

Frequently Asked Questions

What is the IUPAC name of N-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine?
The IUPAC name of N-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine (CID 103625236) is N-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine.
What is the SMILES notation for N-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine?
The canonical SMILES for N-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine is CC(C)NCc1ccc(-c2cccnc2)o1.
What is the InChIKey of N-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine?
The InChIKey is VQVGAFBVPMTIOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-10(2)15-9-12-5-6-13(16-12)11-4-3-7-14-8-11/h3-8,10,15H,9H2,1-2H3.
What are the key properties of N-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine?
N-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine has a molecular weight of 216.28 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-pyridin-3-ylfuran-2-yl)methyl]propan-2-amine is sourced from PubChem (CID 103625236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).