N-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide

C24H25N3O2 — CID 133354183

IUPACN-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide
SMILESCc1ccccc1C1CN(c2ccnc(C(=O)NCc3ccccc3)c2)CCO1
InChIInChI=1S/C24H25N3O2/c1-18-7-5-6-10-21(18)23-17-27(13-14-29-23)20-11-12-25-22(15-20)24(28)26-16-19-8-3-2-4-9-19/h2-12,15,23H,13-14,16-17H2,1H3,(H,26,28)
InChIKeyPOBUZGLZMLHFAX-UHFFFAOYSA-N
MW387.48 g/mol
LogP3.90
Rot. Bonds5

About N-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide

N-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide (PubChem CID 133354183) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is N-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide
PubChem CID133354183
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC NameN-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide
SMILESCc1ccccc1C1CN(c2ccnc(C(=O)NCc3ccccc3)c2)CCO1
InChIInChI=1S/C24H25N3O2/c1-18-7-5-6-10-21(18)23-17-27(13-14-29-23)20-11-12-25-22(15-20)24(28)26-16-19-8-3-2-4-9-19/h2-12,15,23H,13-14,16-17H2,1H3,(H,26,28)
InChIKeyPOBUZGLZMLHFAX-UHFFFAOYSA-N
XLogP3.90
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-4-[(2S)-2-methylthiomorpholin-4-yl]pyridine-2-carboxamide
CID 97316438
4-[(2R)-2-(3,4-difluorophenyl)morpholin-4-yl]-N-ethylpyridine-2-carboxamide
CID 97028949
N-benzyl-4-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxamide
CID 133379384
N-benzyl-4-(4-pyridin-2-ylpiperazin-1-yl)pyridine-2-carboxamide
CID 109209654
4-[3-(2-amino-2-oxoethyl)piperidin-1-yl]-N-benzylpyridine-2-carboxamide
CID 133355871
N-[(5-methyl-3-pyridinyl)methyl]-4-morpholin-4-ylpyridine-2-carboxamide
CID 99634295
(2S)-N-[[3-(hydroxymethyl)phenyl]methyl]-2-(2-methylphenyl)morpholine-4-carboxamide
CID 95934151
4-morpholin-4-yl-N-(2-phenylethyl)pyridine-2-carboxamide
CID 109206585
N-[(4-fluorophenyl)methyl]-4-(4-phenylpiperazin-1-yl)pyridine-2-carboxamide
CID 109211394
N-[(3-methylphenyl)methyl]-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyridine-2-carboxamide
CID 109210191
N-[(3-chlorophenyl)methyl]-4-morpholin-4-ylpyridine-2-carboxamide
CID 9401810
N-benzyl-4-(4-propyl-1,4-diazepan-1-yl)pyridine-2-carboxamide
CID 133342674

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide?
The IUPAC name of N-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide (CID 133354183) is N-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide.
What is the SMILES notation for N-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide?
The canonical SMILES for N-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide is Cc1ccccc1C1CN(c2ccnc(C(=O)NCc3ccccc3)c2)CCO1.
What is the InChIKey of N-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide?
The InChIKey is POBUZGLZMLHFAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c1-18-7-5-6-10-21(18)23-17-27(13-14-29-23)20-11-12-25-22(15-20)24(28)26-16-19-8-3-2-4-9-19/h2-12,15,23H,13-14,16-17H2,1H3,(H,26,28).
What are the key properties of N-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide?
N-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide has a molecular weight of 387.48 g/mol, XLogP of 3.90, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-[2-(2-methylphenyl)morpholin-4-yl]pyridine-2-carboxamide is sourced from PubChem (CID 133354183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).