[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea

C14H19N3O3 — CID 42915501

IUPAC[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea
SMILESCC1CN(C(=O)c2ccc(NC(N)=O)cc2)CC(C)O1
InChIInChI=1S/C14H19N3O3/c1-9-7-17(8-10(2)20-9)13(18)11-3-5-12(6-4-11)16-14(15)19/h3-6,9-10H,7-8H2,1-2H3,(H3,15,16,19)
InChIKeyYWGIQVMWKRDCLU-UHFFFAOYSA-N
MW277.32 g/mol
LogP1.43
Rot. Bonds2

About [4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea

[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea (PubChem CID 42915501) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is [4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea.

Molecular Properties

Compound Name[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea
PubChem CID42915501
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Name[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea
SMILESCC1CN(C(=O)c2ccc(NC(N)=O)cc2)CC(C)O1
InChIInChI=1S/C14H19N3O3/c1-9-7-17(8-10(2)20-9)13(18)11-3-5-12(6-4-11)16-14(15)19/h3-6,9-10H,7-8H2,1-2H3,(H3,15,16,19)
InChIKeyYWGIQVMWKRDCLU-UHFFFAOYSA-N
XLogP1.43
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-(2,6-dimethylmorpholin-4-yl)methanone
CID 618918
1-amino-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]cyclopropane-1-carboxamide
CID 119744203
2-[[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]carbamoyl]cyclobutane-1-carboxylic acid
CID 120975409
1-[[4-[(2S,6R)-2,6-dimethylmorpholine-4-carbonyl]phenyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 129466552
N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 119744220
(2,6-dimethylmorpholin-4-yl)-[4-(ethylamino)phenyl]methanone
CID 62170652
4-[(2S,6S)-2,6-dimethylmorpholine-4-carbonyl]benzoic acid
CID 93051084
4-[(2R,6R)-2,6-dimethylmorpholine-4-carbonyl]benzoic acid
CID 93051085
2-(cyclopropylmethylamino)-N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]acetamide
CID 119744229
(2,6-dimethylmorpholin-4-yl)-[4-(propylamino)phenyl]methanone
CID 62170653
1-[4-(carbamoylamino)benzoyl]-5-methylpiperidine-3-carboxylic acid
CID 122119371
N-[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119744232

Frequently Asked Questions

What is the IUPAC name of [4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea?
The IUPAC name of [4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea (CID 42915501) is [4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea.
What is the SMILES notation for [4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea?
The canonical SMILES for [4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea is CC1CN(C(=O)c2ccc(NC(N)=O)cc2)CC(C)O1.
What is the InChIKey of [4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea?
The InChIKey is YWGIQVMWKRDCLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-9-7-17(8-10(2)20-9)13(18)11-3-5-12(6-4-11)16-14(15)19/h3-6,9-10H,7-8H2,1-2H3,(H3,15,16,19).
What are the key properties of [4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea?
[4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea has a molecular weight of 277.32 g/mol, XLogP of 1.43, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,6-dimethylmorpholine-4-carbonyl)phenyl]urea is sourced from PubChem (CID 42915501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).