N-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide

C20H25N5O2 — CID 3798221

IUPACN-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide
SMILESCN(C)c1ccc(C=NNC(=O)C(c2ccncc2)N2CCOCC2)cc1
InChIInChI=1S/C20H25N5O2/c1-24(2)18-5-3-16(4-6-18)15-22-23-20(26)19(17-7-9-21-10-8-17)25-11-13-27-14-12-25/h3-10,15,19H,11-14H2,1-2H3,(H,23,26)
InChIKeyCTILFURKWKFVLM-UHFFFAOYSA-N
MW367.45 g/mol
LogP1.67
Rot. Bonds6

About N-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide

N-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide (PubChem CID 3798221) has the molecular formula C20H25N5O2 and a molecular weight of 367.45 g/mol. Its IUPAC name is N-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide.

Molecular Properties

Compound NameN-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide
PubChem CID3798221
Molecular FormulaC20H25N5O2
Molecular Weight367.45 g/mol
Exact Mass367.20
IUPAC NameN-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide
SMILESCN(C)c1ccc(C=NNC(=O)C(c2ccncc2)N2CCOCC2)cc1
InChIInChI=1S/C20H25N5O2/c1-24(2)18-5-3-16(4-6-18)15-22-23-20(26)19(17-7-9-21-10-8-17)25-11-13-27-14-12-25/h3-10,15,19H,11-14H2,1-2H3,(H,23,26)
InChIKeyCTILFURKWKFVLM-UHFFFAOYSA-N
XLogP1.67
TPSA70.06 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(4-ethoxy-3-hydroxyphenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide
CID 3454451
2-morpholin-4-yl-2-pyridin-4-ylacetohydrazide
CID 46318243
N-[(2-hydroxy-3,5-dinitrophenyl)methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide
CID 4648875
N-[(E)-[4-(dimethylamino)phenyl]methylideneamino]pyridine-4-carboxamide;hydrate
CID 21230438
2-morpholin-4-yl-2-pyridin-4-ylacetamide
CID 25219323
N-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]-2,2-diphenylacetamide
CID 5499697
N,N'-bis[(E)-[4-(dimethylamino)phenyl]methylideneamino]-2-ethylpropanediamide
CID 45356630
1-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]-3-[[4-(dimethylamino)phenyl]methylideneamino]urea
CID 5355984
ethyl (2S)-2-morpholin-4-yl-2-pyridin-4-ylacetate
CID 124585393
(2R)-N-[[4-(dimethylamino)phenyl]methylideneamino]-2-(4-methylanilino)propanamide
CID 763383
(2S)-N-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]-2-(4-methylanilino)propanamide
CID 5403284
N-[(Z)-(4-chlorophenyl)methylideneamino]-2-phenyl-2-piperidin-1-ylacetamide
CID 6044072

Frequently Asked Questions

What is the IUPAC name of N-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide?
The IUPAC name of N-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide (CID 3798221) is N-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide.
What is the SMILES notation for N-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide?
The canonical SMILES for N-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide is CN(C)c1ccc(C=NNC(=O)C(c2ccncc2)N2CCOCC2)cc1.
What is the InChIKey of N-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide?
The InChIKey is CTILFURKWKFVLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O2/c1-24(2)18-5-3-16(4-6-18)15-22-23-20(26)19(17-7-9-21-10-8-17)25-11-13-27-14-12-25/h3-10,15,19H,11-14H2,1-2H3,(H,23,26).
What are the key properties of N-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide?
N-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide has a molecular weight of 367.45 g/mol, XLogP of 1.67, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(dimethylamino)phenyl]methylideneamino]-2-morpholin-4-yl-2-pyridin-4-ylacetamide is sourced from PubChem (CID 3798221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).