N-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide

C16H20N2O3 — CID 75451734

IUPACN-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide
SMILESCOCCC(NC(=O)CCc1ccncc1)c1ccco1
InChIInChI=1S/C16H20N2O3/c1-20-12-8-14(15-3-2-11-21-15)18-16(19)5-4-13-6-9-17-10-7-13/h2-3,6-7,9-11,14H,4-5,8,12H2,1H3,(H,18,19)
InChIKeyKCUYKNQHTSIJQB-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.50
Rot. Bonds8

About N-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide

N-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide (PubChem CID 75451734) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide.

Molecular Properties

Compound NameN-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide
PubChem CID75451734
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC NameN-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide
SMILESCOCCC(NC(=O)CCc1ccncc1)c1ccco1
InChIInChI=1S/C16H20N2O3/c1-20-12-8-14(15-3-2-11-21-15)18-16(19)5-4-13-6-9-17-10-7-13/h2-3,6-7,9-11,14H,4-5,8,12H2,1H3,(H,18,19)
InChIKeyKCUYKNQHTSIJQB-UHFFFAOYSA-N
XLogP2.50
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-bromo-N-[(1R)-1-(furan-2-yl)-3-methoxypropyl]thiophene-2-carboxamide
CID 129471505
3-(furan-2-yl)-N-[(1S)-1-pyridin-4-ylethyl]propanamide
CID 34761975
1-(furan-2-yl)-N-propyl-3-pyridin-4-ylpropan-1-amine
CID 105146972
(6S)-N-[(1S)-1-(furan-2-yl)-3-methoxypropyl]-6-methyl-1,1-dioxo-1,4-thiazepane-4-carboxamide
CID 124890479
N'-[1-(furan-2-yl)-3-methoxypropyl]-N-[2-[(3-methylphenyl)methyl]pyrazol-3-yl]oxamide
CID 166205830
methyl 3-pyridin-4-ylpropanoate
CID 3704115
3-hydroxy-2-(3-pyridin-4-ylpropanoylamino)butanoic acid
CID 113269883
1-(furan-2-yl)-N-(2-pyridin-4-ylethyl)ethanamine
CID 60721044
2-[3-(furan-2-carbonylamino)propanoylamino]-4-methoxybutanoic acid
CID 62479824
N-[(2-methoxyphenyl)methyl]-3-pyridin-4-ylpropanamide
CID 110468458
4-methoxy-2-(2-pyridin-4-ylethylsulfonylamino)butanoic acid
CID 62479861
1-[4-[[(1R)-1-(furan-2-yl)-3-methoxypropyl]amino]-3-nitrophenyl]ethanone
CID 97346178

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide?
The IUPAC name of N-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide (CID 75451734) is N-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide.
What is the SMILES notation for N-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide?
The canonical SMILES for N-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide is COCCC(NC(=O)CCc1ccncc1)c1ccco1.
What is the InChIKey of N-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide?
The InChIKey is KCUYKNQHTSIJQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-20-12-8-14(15-3-2-11-21-15)18-16(19)5-4-13-6-9-17-10-7-13/h2-3,6-7,9-11,14H,4-5,8,12H2,1H3,(H,18,19).
What are the key properties of N-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide?
N-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide has a molecular weight of 288.35 g/mol, XLogP of 2.50, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)-3-methoxypropyl]-3-pyridin-4-ylpropanamide is sourced from PubChem (CID 75451734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).