2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide

C16H21N3O3 — CID 87038703

IUPAC2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide
SMILESCN(C)c1ncccc1C(=O)NCCCOCc1ccco1
InChIInChI=1S/C16H21N3O3/c1-19(2)15-14(7-3-8-17-15)16(20)18-9-5-10-21-12-13-6-4-11-22-13/h3-4,6-8,11H,5,9-10,12H2,1-2H3,(H,18,20)
InChIKeyWCUKANHOWAMWIU-UHFFFAOYSA-N
MW303.36 g/mol
LogP2.08
Rot. Bonds8

About 2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide

2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide (PubChem CID 87038703) has the molecular formula C16H21N3O3 and a molecular weight of 303.36 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide
PubChem CID87038703
Molecular FormulaC16H21N3O3
Molecular Weight303.36 g/mol
Exact Mass303.16
IUPAC Name2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide
SMILESCN(C)c1ncccc1C(=O)NCCCOCc1ccco1
InChIInChI=1S/C16H21N3O3/c1-19(2)15-14(7-3-8-17-15)16(20)18-9-5-10-21-12-13-6-4-11-22-13/h3-4,6-8,11H,5,9-10,12H2,1-2H3,(H,18,20)
InChIKeyWCUKANHOWAMWIU-UHFFFAOYSA-N
XLogP2.08
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(furan-2-ylmethoxy)propyl]quinoline-8-carboxamide
CID 51296890
N-[3-(furan-2-ylmethoxy)propyl]-2-(methanesulfonamido)benzamide
CID 51296855
5-amino-N-[3-(furan-2-ylmethoxy)propyl]-1-methylpyrazole-4-carboxamide
CID 75397489
methyl 6-[3-(furan-2-ylmethoxy)propylcarbamoyl]pyridine-3-carboxylate
CID 86921232
1-[3-(furan-2-ylmethoxy)propyl]-3-[[2-(2-methoxyethoxy)-3-pyridinyl]methyl]-2-methylguanidine;hydroiodide
CID 111398526
2,6-dichloro-N-[3-(furan-2-ylmethoxy)propyl]pyridine-4-carboxamide
CID 60706210
N-[3-(furan-2-ylmethoxy)propyl]-4-methylsulfanylbenzamide
CID 78832996
3-amino-N-[3-(furan-2-ylmethoxy)propyl]-1H-1,2,4-triazole-5-carboxamide
CID 55115340
N-[3-(furan-2-ylmethoxy)propyl]-2-(N-methylanilino)acetamide
CID 86914416
N-[3-(furan-2-ylmethoxy)propyl]-4-(methylsulfanylmethyl)benzamide
CID 86914792
6-fluoro-N-[3-(furan-2-ylmethoxy)propyl]pyridine-2-carboxamide
CID 115497634
N-[3-(furan-2-ylmethoxy)propyl]-3,5-dimethyl-4-(pyridin-3-ylmethoxy)benzamide
CID 55853611

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide?
The IUPAC name of 2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide (CID 87038703) is 2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide?
The canonical SMILES for 2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide is CN(C)c1ncccc1C(=O)NCCCOCc1ccco1.
What is the InChIKey of 2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide?
The InChIKey is WCUKANHOWAMWIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O3/c1-19(2)15-14(7-3-8-17-15)16(20)18-9-5-10-21-12-13-6-4-11-22-13/h3-4,6-8,11H,5,9-10,12H2,1-2H3,(H,18,20).
What are the key properties of 2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide?
2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide has a molecular weight of 303.36 g/mol, XLogP of 2.08, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[3-(furan-2-ylmethoxy)propyl]pyridine-3-carboxamide is sourced from PubChem (CID 87038703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).