N-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide

C15H23N3O3 — CID 103113367

IUPACN-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)NC(=O)Nc1cccc(C(C)O)c1
InChIInChI=1S/C15H23N3O3/c1-5-18(4)14(20)10(2)16-15(21)17-13-8-6-7-12(9-13)11(3)19/h6-11,19H,5H2,1-4H3,(H2,16,17,21)
InChIKeyCQTOPAXGXRDFMV-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.73
Rot. Bonds5

About N-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide

N-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide (PubChem CID 103113367) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide.

Molecular Properties

Compound NameN-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide
PubChem CID103113367
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC NameN-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide
SMILESCCN(C)C(=O)C(C)NC(=O)Nc1cccc(C(C)O)c1
InChIInChI=1S/C15H23N3O3/c1-5-18(4)14(20)10(2)16-15(21)17-13-8-6-7-12(9-13)11(3)19/h6-11,19H,5H2,1-4H3,(H2,16,17,21)
InChIKeyCQTOPAXGXRDFMV-UHFFFAOYSA-N
XLogP1.73
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(1-hydroxyethyl)phenyl]-3-(3-methylpentan-2-yl)urea
CID 61466439
1-(3-ethylpentan-2-yl)-3-[3-(1-hydroxyethyl)phenyl]urea
CID 63836496
1-[3-(1-hydroxyethyl)phenyl]-3-octan-2-ylurea
CID 61478879
(2S)-N-ethyl-N-methyl-2-[(4-phenylmethoxyphenyl)carbamoylamino]propanamide
CID 124735239
1-(4-fluorophenyl)-3-[3-(1-hydroxyethyl)phenyl]urea
CID 43508550
2-[[3-[1-(ethylamino)ethyl]phenyl]carbamoylamino]-N-methylpropanamide
CID 61466725
1-ethyl-1-(2-ethylbutyl)-3-[3-(1-hydroxyethyl)phenyl]urea
CID 61438276
1-propan-2-yl-3-(3-propan-2-ylphenyl)urea
CID 47173712
1,1-dibutyl-3-[3-(1-hydroxyethyl)phenyl]urea
CID 61348218
1-[3-(1-hydroxyethyl)phenyl]-3-[(1-methylimidazol-2-yl)methyl]urea
CID 63295753
(2R)-N-[3-[(1S)-1-hydroxyethyl]phenyl]-2-phenylbutanamide
CID 7314172
1-[3-(1-hydroxyethyl)phenyl]-3-(2-phenylethyl)urea
CID 61347620

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide?
The IUPAC name of N-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide (CID 103113367) is N-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide.
What is the SMILES notation for N-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide?
The canonical SMILES for N-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide is CCN(C)C(=O)C(C)NC(=O)Nc1cccc(C(C)O)c1.
What is the InChIKey of N-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide?
The InChIKey is CQTOPAXGXRDFMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-5-18(4)14(20)10(2)16-15(21)17-13-8-6-7-12(9-13)11(3)19/h6-11,19H,5H2,1-4H3,(H2,16,17,21).
What are the key properties of N-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide?
N-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide has a molecular weight of 293.37 g/mol, XLogP of 1.73, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[[3-(1-hydroxyethyl)phenyl]carbamoylamino]-N-methylpropanamide is sourced from PubChem (CID 103113367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).