1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea

C18H24N2O4 — CID 97219041

IUPAC1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea
SMILESCC[C@H](NC(=O)NC[C@@](C)(O)c1ccco1)c1ccccc1OC
InChIInChI=1S/C18H24N2O4/c1-4-14(13-8-5-6-9-15(13)23-3)20-17(21)19-12-18(2,22)16-10-7-11-24-16/h5-11,14,22H,4,12H2,1-3H3,(H2,19,20,21)/t14-,18+/m0/s1
InChIKeyOVCBAYLJKWNDBZ-KBXCAEBGSA-N
MW332.40 g/mol
LogP2.95
Rot. Bonds7

About 1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea

1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea (PubChem CID 97219041) has the molecular formula C18H24N2O4 and a molecular weight of 332.40 g/mol. Its IUPAC name is 1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea.

Molecular Properties

Compound Name1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea
PubChem CID97219041
Molecular FormulaC18H24N2O4
Molecular Weight332.40 g/mol
Exact Mass332.17
IUPAC Name1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea
SMILESCC[C@H](NC(=O)NC[C@@](C)(O)c1ccco1)c1ccccc1OC
InChIInChI=1S/C18H24N2O4/c1-4-14(13-8-5-6-9-15(13)23-3)20-17(21)19-12-18(2,22)16-10-7-11-24-16/h5-11,14,22H,4,12H2,1-3H3,(H2,19,20,21)/t14-,18+/m0/s1
InChIKeyOVCBAYLJKWNDBZ-KBXCAEBGSA-N
XLogP2.95
TPSA83.73 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 52.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea with MolForge

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Related Compounds

1-[2-(furan-2-yl)-2-hydroxypropyl]-3-[1-(4-methylphenyl)propyl]urea
CID 111504031
N-[(2S)-2-(furan-2-yl)-2-hydroxypropyl]-2-methoxybenzamide
CID 95983592
1-[(2S)-3,3-dimethylbutan-2-yl]-3-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]urea
CID 95934768
1-(2,3-dimethoxyphenyl)-3-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]urea
CID 95983787
1-[2-(furan-2-yl)-2-hydroxypropyl]-3-(1-phenylethyl)urea
CID 111478738
methyl N-[2-(furan-2-yl)-2-hydroxypropyl]carbamate
CID 121085806
1-[2-(furan-2-yl)-2-hydroxypropyl]-3-[1-(2-methylpropoxy)propan-2-yl]urea
CID 111480769
N-[2-(furan-2-yl)-2-hydroxypropyl]-2-(2-methoxyphenyl)cyclopropane-1-carboxamide
CID 111482672
1-[2-(furan-2-yl)-2-hydroxypropyl]-3-(1,1,1-trifluoro-4,4-dimethylpentan-2-yl)urea
CID 110007216
1-[2-(furan-2-yl)-2-hydroxypropyl]-3-(2,2,2-trifluoroethyl)urea
CID 111474174
1-[1-(4-chlorophenyl)ethyl]-3-[2-(furan-2-yl)-2-hydroxypropyl]urea
CID 111478745
(2R)-2-amino-N-[1-(2-methoxyphenyl)propyl]-3,3-dimethylbutanamide
CID 103928736

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea?
The IUPAC name of 1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea (CID 97219041) is 1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea.
What is the SMILES notation for 1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea?
The canonical SMILES for 1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea is CC[C@H](NC(=O)NC[C@@](C)(O)c1ccco1)c1ccccc1OC.
What is the InChIKey of 1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea?
The InChIKey is OVCBAYLJKWNDBZ-KBXCAEBGSA-N. The full InChI is InChI=1S/C18H24N2O4/c1-4-14(13-8-5-6-9-15(13)23-3)20-17(21)19-12-18(2,22)16-10-7-11-24-16/h5-11,14,22H,4,12H2,1-3H3,(H2,19,20,21)/t14-,18+/m0/s1.
What are the key properties of 1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea?
1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea has a molecular weight of 332.40 g/mol, XLogP of 2.95, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-(furan-2-yl)-2-hydroxypropyl]-3-[(1S)-1-(2-methoxyphenyl)propyl]urea is sourced from PubChem (CID 97219041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).