1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea

C18H24N2O3 — CID 56789155

IUPAC1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea
SMILESCCN(Cc1ccoc1)C(=O)NC(C)Cc1cccc(OC)c1
InChIInChI=1S/C18H24N2O3/c1-4-20(12-16-8-9-23-13-16)18(21)19-14(2)10-15-6-5-7-17(11-15)22-3/h5-9,11,13-14H,4,10,12H2,1-3H3,(H,19,21)
InChIKeyGNRRBRJROFUUAV-UHFFFAOYSA-N
MW316.40 g/mol
LogP3.45
Rot. Bonds7

About 1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea

1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea (PubChem CID 56789155) has the molecular formula C18H24N2O3 and a molecular weight of 316.40 g/mol. Its IUPAC name is 1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea.

Molecular Properties

Compound Name1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea
PubChem CID56789155
Molecular FormulaC18H24N2O3
Molecular Weight316.40 g/mol
Exact Mass316.18
IUPAC Name1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea
SMILESCCN(Cc1ccoc1)C(=O)NC(C)Cc1cccc(OC)c1
InChIInChI=1S/C18H24N2O3/c1-4-20(12-16-8-9-23-13-16)18(21)19-14(2)10-15-6-5-7-17(11-15)22-3/h5-9,11,13-14H,4,10,12H2,1-3H3,(H,19,21)
InChIKeyGNRRBRJROFUUAV-UHFFFAOYSA-N
XLogP3.45
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-3-[1-(3-methoxyphenyl)propan-2-yl]-1-propan-2-ylurea
CID 86943865
N-[1-(3-methoxyphenyl)propan-2-yl]acetamide
CID 541954
N-[(2R)-1-(3-methoxyphenyl)propan-2-yl]butanamide
CID 174918939
N-[1-(3-methoxyphenyl)propan-2-yl]butanamide
CID 174918913
1-ethyl-1-[1-(4-fluorophenyl)ethyl]-3-[1-(3-methoxyphenyl)propan-2-yl]urea
CID 86943844
N-[1-(furan-3-yl)propan-2-yl]-2,4-dimethoxybenzamide
CID 121127019
1-ethyl-1-(furan-3-ylmethyl)-3-[(2R)-2-methoxy-2-phenylethyl]urea
CID 95637612
3-[1-(3-methoxyphenyl)propan-2-yl]-1-methyl-1-[2-(3-methylphenoxy)ethyl]urea
CID 86943339
3-[(2S)-1-(3-methoxyphenyl)propan-2-yl]-1-methyl-1-[(1R)-1-pyridin-2-ylethyl]urea
CID 96532415
(2R)-4-ethyl-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]morpholine-2-carboxamide
CID 95909052
(2S)-2-amino-N-ethyl-N-[(3-methoxyphenyl)methyl]-3-methylbutanamide
CID 66568463
2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide
CID 96532447

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea?
The IUPAC name of 1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea (CID 56789155) is 1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea.
What is the SMILES notation for 1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea?
The canonical SMILES for 1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea is CCN(Cc1ccoc1)C(=O)NC(C)Cc1cccc(OC)c1.
What is the InChIKey of 1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea?
The InChIKey is GNRRBRJROFUUAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O3/c1-4-20(12-16-8-9-23-13-16)18(21)19-14(2)10-15-6-5-7-17(11-15)22-3/h5-9,11,13-14H,4,10,12H2,1-3H3,(H,19,21).
What are the key properties of 1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea?
1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea has a molecular weight of 316.40 g/mol, XLogP of 3.45, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-(furan-3-ylmethyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea is sourced from PubChem (CID 56789155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).