1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea

C20H28N4O3 — CID 119060016

IUPAC1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea
SMILESCCN(Cc1ccc(C)o1)C(=O)NCC(c1ccccn1)N1CCOCC1
InChIInChI=1S/C20H28N4O3/c1-3-23(15-17-8-7-16(2)27-17)20(25)22-14-19(18-6-4-5-9-21-18)24-10-12-26-13-11-24/h4-9,19H,3,10-15H2,1-2H3,(H,22,25)
InChIKeyCUACBISKMLHWRG-UHFFFAOYSA-N
MW372.47 g/mol
LogP2.59
Rot. Bonds7

About 1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea

1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea (PubChem CID 119060016) has the molecular formula C20H28N4O3 and a molecular weight of 372.47 g/mol. Its IUPAC name is 1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea.

Molecular Properties

Compound Name1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea
PubChem CID119060016
Molecular FormulaC20H28N4O3
Molecular Weight372.47 g/mol
Exact Mass372.22
IUPAC Name1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea
SMILESCCN(Cc1ccc(C)o1)C(=O)NCC(c1ccccn1)N1CCOCC1
InChIInChI=1S/C20H28N4O3/c1-3-23(15-17-8-7-16(2)27-17)20(25)22-14-19(18-6-4-5-9-21-18)24-10-12-26-13-11-24/h4-9,19H,3,10-15H2,1-2H3,(H,22,25)
InChIKeyCUACBISKMLHWRG-UHFFFAOYSA-N
XLogP2.59
TPSA70.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea with MolForge

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Related Compounds

N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]pyridine-2-carboxamide
CID 51074519
1-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-pyridin-2-ylurea
CID 51083980
3-methyl-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide
CID 176504455
N-[(2S)-2-morpholin-4-yl-2-pyridin-2-ylethyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 96571971
4-hydroxy-N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)cyclohexane-1-carboxamide
CID 77094687
N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide
CID 131898064
N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide
CID 70776358
5-hydroxy-N-[(2R)-2-morpholin-4-yl-2-pyridin-2-ylethyl]pyridine-2-carboxamide
CID 99941083
2-morpholin-4-yl-2-pyridin-2-ylethanol
CID 91095032
N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide
CID 72938175
N-[(2R)-2-morpholin-4-yl-2-pyridin-2-ylethyl]-2-propyl-1,3-thiazole-4-carboxamide
CID 97155288
4-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 18164209

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea?
The IUPAC name of 1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea (CID 119060016) is 1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea.
What is the SMILES notation for 1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea?
The canonical SMILES for 1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea is CCN(Cc1ccc(C)o1)C(=O)NCC(c1ccccn1)N1CCOCC1.
What is the InChIKey of 1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea?
The InChIKey is CUACBISKMLHWRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O3/c1-3-23(15-17-8-7-16(2)27-17)20(25)22-14-19(18-6-4-5-9-21-18)24-10-12-26-13-11-24/h4-9,19H,3,10-15H2,1-2H3,(H,22,25).
What are the key properties of 1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea?
1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea has a molecular weight of 372.47 g/mol, XLogP of 2.59, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-[(5-methylfuran-2-yl)methyl]-3-(2-morpholin-4-yl-2-pyridin-2-ylethyl)urea is sourced from PubChem (CID 119060016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).