N-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide

C12H23N3O3 — CID 83032833

IUPACN-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide
SMILESCCC1(CC)CC(NCC(=O)NC(N)=O)CCO1
InChIInChI=1S/C12H23N3O3/c1-3-12(4-2)7-9(5-6-18-12)14-8-10(16)15-11(13)17/h9,14H,3-8H2,1-2H3,(H3,13,15,16,17)
InChIKeyPFCQJWOXUAVFNP-UHFFFAOYSA-N
MW257.33 g/mol
LogP0.51
Rot. Bonds5

About N-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide

N-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide (PubChem CID 83032833) has the molecular formula C12H23N3O3 and a molecular weight of 257.33 g/mol. Its IUPAC name is N-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide.

Molecular Properties

Compound NameN-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide
PubChem CID83032833
Molecular FormulaC12H23N3O3
Molecular Weight257.33 g/mol
Exact Mass257.17
IUPAC NameN-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide
SMILESCCC1(CC)CC(NCC(=O)NC(N)=O)CCO1
InChIInChI=1S/C12H23N3O3/c1-3-12(4-2)7-9(5-6-18-12)14-8-10(16)15-11(13)17/h9,14H,3-8H2,1-2H3,(H3,13,15,16,17)
InChIKeyPFCQJWOXUAVFNP-UHFFFAOYSA-N
XLogP0.51
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 50.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2,2-diethyloxan-4-yl)amino]-N-methylacetamide
CID 83032578
N-cyclopropyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide
CID 83032670
2-[(2,2-diethyloxan-4-yl)amino]-N-(oxan-4-yl)acetamide
CID 83036427
2-[(2,2-diethyloxan-4-yl)amino]-1-morpholin-4-ylethanone
CID 83033676
2,2-diethyl-N-(2,2,2-trifluoroethyl)oxan-4-amine
CID 83033348
N-(2,2-dimethylpropyl)-2,2-diethyloxan-4-amine
CID 82760396
methyl 3-[(2,2-diethyloxan-4-yl)amino]-2-methylpropanoate
CID 83033168
3-amino-3-cyclopropyl-N-(2,2-diethyloxan-4-yl)propanamide
CID 83028921
1-amino-N-(2,2-diethyloxan-4-yl)cyclobutane-1-carboxamide
CID 83028998
2-amino-N-(2,2-diethyloxan-4-yl)butanediamide
CID 83028377
N-(2,2-diethyloxan-4-yl)-2-(prop-2-enylamino)acetamide
CID 83028302
N-carbamoyl-2-(cycloheptylamino)acetamide
CID 43236721

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide?
The IUPAC name of N-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide (CID 83032833) is N-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide.
What is the SMILES notation for N-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide?
The canonical SMILES for N-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide is CCC1(CC)CC(NCC(=O)NC(N)=O)CCO1.
What is the InChIKey of N-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide?
The InChIKey is PFCQJWOXUAVFNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O3/c1-3-12(4-2)7-9(5-6-18-12)14-8-10(16)15-11(13)17/h9,14H,3-8H2,1-2H3,(H3,13,15,16,17).
What are the key properties of N-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide?
N-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide has a molecular weight of 257.33 g/mol, XLogP of 0.51, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-[(2,2-diethyloxan-4-yl)amino]acetamide is sourced from PubChem (CID 83032833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).