N-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide

C14H25N3O4 — CID 154789786

IUPACN-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide
SMILESCOCCN1CN(C(=O)NC2CCOC(C)(C)C2)CC1=O
InChIInChI=1S/C14H25N3O4/c1-14(2)8-11(4-6-21-14)15-13(19)17-9-12(18)16(10-17)5-7-20-3/h11H,4-10H2,1-3H3,(H,15,19)
InChIKeyDOPGZBLBHGHUKD-UHFFFAOYSA-N
MW299.37 g/mol
LogP0.40
Rot. Bonds4

About N-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide

N-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide (PubChem CID 154789786) has the molecular formula C14H25N3O4 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide.

Molecular Properties

Compound NameN-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide
PubChem CID154789786
Molecular FormulaC14H25N3O4
Molecular Weight299.37 g/mol
Exact Mass299.18
IUPAC NameN-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide
SMILESCOCCN1CN(C(=O)NC2CCOC(C)(C)C2)CC1=O
InChIInChI=1S/C14H25N3O4/c1-14(2)8-11(4-6-21-14)15-13(19)17-9-12(18)16(10-17)5-7-20-3/h11H,4-10H2,1-3H3,(H,15,19)
InChIKeyDOPGZBLBHGHUKD-UHFFFAOYSA-N
XLogP0.40
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[4-(2-methoxyethyl)-3-oxo-1,4-diazepane-1-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 122024221
1-[(2,2-dimethyloxan-4-yl)carbamoyl]-3-methylpyrrolidine-3-carboxylic acid
CID 83029338
2-[4-[(2,2-dimethyloxan-4-yl)carbamoyl]morpholin-2-yl]acetic acid
CID 83034767
N-(cyanomethyl)-N'-(2,2-dimethyloxan-4-yl)oxamide
CID 83028549
2-[(2,2-dimethyloxan-4-yl)amino]-N-(2-methoxyethyl)acetamide
CID 83032655
3-(2-methoxyethyl)-N-[(4-methylsulfanylphenyl)methyl]-4-oxoimidazolidine-1-carboxamide
CID 154755933
N-(2,2-dimethyloxan-4-yl)butanamide
CID 115563895
3-(2-methoxyethyl)-1-(5-methylpyrazine-2-carbonyl)imidazolidin-4-one
CID 146083959
N-(2,2-dimethyloxan-4-yl)-1-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106578749
methyl 3-[(2,2-dimethyloxan-4-yl)amino]butanoate
CID 83032645
2-amino-N-(2,2-dimethyloxan-4-yl)butanediamide
CID 83033094
1-[2-(dimethylamino)butanoyl]-3-(2-methoxyethyl)imidazolidin-4-one
CID 132970563

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide?
The IUPAC name of N-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide (CID 154789786) is N-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide.
What is the SMILES notation for N-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide?
The canonical SMILES for N-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide is COCCN1CN(C(=O)NC2CCOC(C)(C)C2)CC1=O.
What is the InChIKey of N-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide?
The InChIKey is DOPGZBLBHGHUKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O4/c1-14(2)8-11(4-6-21-14)15-13(19)17-9-12(18)16(10-17)5-7-20-3/h11H,4-10H2,1-3H3,(H,15,19).
What are the key properties of N-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide?
N-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide has a molecular weight of 299.37 g/mol, XLogP of 0.40, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyloxan-4-yl)-3-(2-methoxyethyl)-4-oxoimidazolidine-1-carboxamide is sourced from PubChem (CID 154789786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).