1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea

C10H20N2O2 — CID 116657948

IUPAC1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea
SMILESCCN(C)C(=O)NC1(C)CCOCC1
InChIInChI=1S/C10H20N2O2/c1-4-12(3)9(13)11-10(2)5-7-14-8-6-10/h4-8H2,1-3H3,(H,11,13)
InChIKeyCMANNBDRSLEHNK-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.22
Rot. Bonds2

About 1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea

1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea (PubChem CID 116657948) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea.

Molecular Properties

Compound Name1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea
PubChem CID116657948
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea
SMILESCCN(C)C(=O)NC1(C)CCOCC1
InChIInChI=1S/C10H20N2O2/c1-4-12(3)9(13)11-10(2)5-7-14-8-6-10/h4-8H2,1-3H3,(H,11,13)
InChIKeyCMANNBDRSLEHNK-UHFFFAOYSA-N
XLogP1.22
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-N-(4-methyloxan-4-yl)acetamide
CID 18437326
(2R)-2-hydroxy-N-(4-methyloxan-4-yl)propanamide
CID 130718981
N-(4-methyloxan-4-yl)-2-sulfanylpropanamide
CID 107035609
3-[methyl-[(1-methylcyclopentyl)carbamoyl]amino]propanoic acid
CID 64688064
1-tert-butyl-3-(4-methyloxan-4-yl)urea
CID 116657944
2-[(4-methyloxan-4-yl)carbamoylamino]pentanoic acid
CID 113491249
1-(4-methyloxan-4-yl)-3-propylthiourea
CID 116510244
1,1-diethyl-3-(4-methylpiperidin-4-yl)urea
CID 114696676
4-[[(2-hydroxy-2-methylpropyl)-methylcarbamoyl]amino]oxane-4-carboxylic acid
CID 115293279
(2S)-3-methyl-2-[(4-methyloxan-4-yl)carbamoylamino]pentanoic acid
CID 113491250
3-amino-1-[(4-hydroxyoxan-4-yl)methyl]-1-methylurea
CID 114951120
3-amino-2,2,3-trimethyl-N-(4-methyloxan-4-yl)butanamide
CID 113491107

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea?
The IUPAC name of 1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea (CID 116657948) is 1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea.
What is the SMILES notation for 1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea?
The canonical SMILES for 1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea is CCN(C)C(=O)NC1(C)CCOCC1.
What is the InChIKey of 1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea?
The InChIKey is CMANNBDRSLEHNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-4-12(3)9(13)11-10(2)5-7-14-8-6-10/h4-8H2,1-3H3,(H,11,13).
What are the key properties of 1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea?
1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea has a molecular weight of 200.28 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-methyl-3-(4-methyloxan-4-yl)urea is sourced from PubChem (CID 116657948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).