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

C19H22FN3O2 — CID 53186022

IUPACN-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
SMILESO=C(CCc1ccnc(N2CCOCC2)c1)NCc1ccccc1F
InChIInChI=1S/C19H22FN3O2/c20-17-4-2-1-3-16(17)14-22-19(24)6-5-15-7-8-21-18(13-15)23-9-11-25-12-10-23/h1-4,7-8,13H,5-6,9-12,14H2,(H,22,24)
InChIKeyJMGCODIIGWQJOO-UHFFFAOYSA-N
MW343.40 g/mol
LogP2.31
Rot. Bonds6

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

N-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide (PubChem CID 53186022) has the molecular formula C19H22FN3O2 and a molecular weight of 343.40 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
PubChem CID53186022
Molecular FormulaC19H22FN3O2
Molecular Weight343.40 g/mol
Exact Mass343.17
IUPAC NameN-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
SMILESO=C(CCc1ccnc(N2CCOCC2)c1)NCc1ccccc1F
InChIInChI=1S/C19H22FN3O2/c20-17-4-2-1-3-16(17)14-22-19(24)6-5-15-7-8-21-18(13-15)23-9-11-25-12-10-23/h1-4,7-8,13H,5-6,9-12,14H2,(H,22,24)
InChIKeyJMGCODIIGWQJOO-UHFFFAOYSA-N
XLogP2.31
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.40
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
CID 53186208
N-[(2-morpholin-4-yl-4-pyridinyl)methyl]butanamide
CID 32585359
2-(2-methylphenyl)-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]acetamide
CID 32586117
N-[(2-methoxyphenyl)methyl]-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 53185909
N-cyclopropyl-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
CID 53186023
N-[2-(4-ethylpiperazin-1-yl)ethyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide
CID 53186075
2-methyl-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]propanamide
CID 32585275
3-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]propanamide
CID 32587581
2-methoxy-N-[3-[(2-morpholin-4-yl-4-pyridinyl)methylamino]-3-oxopropyl]benzamide
CID 32584361
1-[2-(2-bromophenyl)ethyl]-3-[(2-morpholin-4-yl-4-pyridinyl)methyl]urea
CID 48964032
3-amino-N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]propanamide
CID 119841583
N-ethyl-3-(2-pyrrolidin-1-yl-4-pyridinyl)propanamide
CID 83273482

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide?
The IUPAC name of N-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide (CID 53186022) is N-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide is O=C(CCc1ccnc(N2CCOCC2)c1)NCc1ccccc1F.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide?
The InChIKey is JMGCODIIGWQJOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN3O2/c20-17-4-2-1-3-16(17)14-22-19(24)6-5-15-7-8-21-18(13-15)23-9-11-25-12-10-23/h1-4,7-8,13H,5-6,9-12,14H2,(H,22,24).
What are the key properties of N-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide?
N-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide has a molecular weight of 343.40 g/mol, XLogP of 2.31, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-3-(2-morpholin-4-yl-4-pyridinyl)propanamide is sourced from PubChem (CID 53186022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).