3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide

C16H19N3O3 — CID 18139639

IUPAC3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide
SMILESCc1ccoc1C(=O)NCc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C16H19N3O3/c1-12-4-7-22-15(12)16(20)18-11-13-2-3-14(17-10-13)19-5-8-21-9-6-19/h2-4,7,10H,5-6,8-9,11H2,1H3,(H,18,20)
InChIKeyVMLIJYHDPIXTBD-UHFFFAOYSA-N
MW301.35 g/mol
LogP1.75
Rot. Bonds4

About 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide

3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide (PubChem CID 18139639) has the molecular formula C16H19N3O3 and a molecular weight of 301.35 g/mol. Its IUPAC name is 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide
PubChem CID18139639
Molecular FormulaC16H19N3O3
Molecular Weight301.35 g/mol
Exact Mass301.14
IUPAC Name3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide
SMILESCc1ccoc1C(=O)NCc1ccc(N2CCOCC2)nc1
InChIInChI=1S/C16H19N3O3/c1-12-4-7-22-15(12)16(20)18-11-13-2-3-14(17-10-13)19-5-8-21-9-6-19/h2-4,7,10H,5-6,8-9,11H2,1H3,(H,18,20)
InChIKeyVMLIJYHDPIXTBD-UHFFFAOYSA-N
XLogP1.75
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,5-dimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]thiophene-3-carboxamide
CID 37274285
4-chloro-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]benzamide
CID 17424871
4-(methylsulfanylmethyl)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]benzamide
CID 30354650
(1R)-2,2-dichloro-1-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]cyclopropane-1-carboxamide
CID 42473931
3-chloro-2-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
CID 62727165
2-methoxy-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]propanamide
CID 47303387
2-(4-aminophenyl)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]acetamide;dihydrochloride
CID 119839439
2-methyl-3-[(6-morpholin-4-yl-3-pyridinyl)methylamino]-3-oxopropanoic acid
CID 114897147
tert-butyl N-[(6-morpholin-4-yl-3-pyridinyl)methyl]carbamate
CID 63787976
3,4,6-trimethyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]thieno[2,3-b]pyridine-2-carboxamide
CID 17424117
4-(2-methylpropoxy)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]benzamide
CID 16602299
N-[(6-morpholin-4-yl-3-pyridinyl)methyl]-2-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 42474431

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide?
The IUPAC name of 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide (CID 18139639) is 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide.
What is the SMILES notation for 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide?
The canonical SMILES for 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide is Cc1ccoc1C(=O)NCc1ccc(N2CCOCC2)nc1.
What is the InChIKey of 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide?
The InChIKey is VMLIJYHDPIXTBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3/c1-12-4-7-22-15(12)16(20)18-11-13-2-3-14(17-10-13)19-5-8-21-9-6-19/h2-4,7,10H,5-6,8-9,11H2,1H3,(H,18,20).
What are the key properties of 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide?
3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide has a molecular weight of 301.35 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]furan-2-carboxamide is sourced from PubChem (CID 18139639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).