N-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide

C18H23N3O3 — CID 53186208

IUPACN-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
SMILESCc1ccc(CNC(=O)CCc2ccnc(N3CCOCC3)c2)o1
InChIInChI=1S/C18H23N3O3/c1-14-2-4-16(24-14)13-20-18(22)5-3-15-6-7-19-17(12-15)21-8-10-23-11-9-21/h2,4,6-7,12H,3,5,8-11,13H2,1H3,(H,20,22)
InChIKeySRULCCSEOVSLBQ-UHFFFAOYSA-N
MW329.40 g/mol
LogP2.07
Rot. Bonds6

About N-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide

N-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide (PubChem CID 53186208) has the molecular formula C18H23N3O3 and a molecular weight of 329.40 g/mol. Its IUPAC name is N-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide.

Molecular Properties

Compound NameN-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
PubChem CID53186208
Molecular FormulaC18H23N3O3
Molecular Weight329.40 g/mol
Exact Mass329.17
IUPAC NameN-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
SMILESCc1ccc(CNC(=O)CCc2ccnc(N3CCOCC3)c2)o1
InChIInChI=1S/C18H23N3O3/c1-14-2-4-16(24-14)13-20-18(22)5-3-15-6-7-19-17(12-15)21-8-10-23-11-9-21/h2,4,6-7,12H,3,5,8-11,13H2,1H3,(H,20,22)
InChIKeySRULCCSEOVSLBQ-UHFFFAOYSA-N
XLogP2.07
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide
CID 32585359
N-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
CID 53186022
3-[3,5-dimethyl-1-(6-morpholin-4-ylpyrimidin-4-yl)pyrazol-4-yl]-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 53069605
N-[2-(4-ethylpiperazin-1-yl)ethyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
CID 53186075
N-cyclopropyl-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
CID 53186023
1-[4-(4-methylphenyl)piperazin-1-yl]-3-(2-morpholin-4-yl-4-pyridinyl)propan-1-one
CID 53186207
2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide
CID 32586117
N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 83273482
3-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]propanamide
CID 32587581
tert-butyl N-[3-[(2-morpholin-4-yl-4-pyridinyl)methylamino]-3-oxopropyl]carbamate
CID 32586659
2-methyl-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]propanamide
CID 32585275
3-(3-methylphenyl)-N-[[2-(4-methylpiperazin-1-yl)-4-pyridinyl]methyl]propanamide
CID 55742598

Frequently Asked Questions

What is the IUPAC name of N-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide?
The IUPAC name of N-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide (CID 53186208) is N-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide.
What is the SMILES notation for N-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide?
The canonical SMILES for N-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide is Cc1ccc(CNC(=O)CCc2ccnc(N3CCOCC3)c2)o1.
What is the InChIKey of N-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide?
The InChIKey is SRULCCSEOVSLBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3/c1-14-2-4-16(24-14)13-20-18(22)5-3-15-6-7-19-17(12-15)21-8-10-23-11-9-21/h2,4,6-7,12H,3,5,8-11,13H2,1H3,(H,20,22).
What are the key properties of N-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide?
N-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide has a molecular weight of 329.40 g/mol, XLogP of 2.07, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide is sourced from PubChem (CID 53186208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).