1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea

C18H26N2O3 — CID 71868395

IUPAC1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea
SMILESCOc1ccccc1C1(CNC(=O)NCC2CCCC2O)CC1
InChIInChI=1S/C18H26N2O3/c1-23-16-8-3-2-6-14(16)18(9-10-18)12-20-17(22)19-11-13-5-4-7-15(13)21/h2-3,6,8,13,15,21H,4-5,7,9-12H2,1H3,(H2,19,20,22)
InChIKeyXDXGSKNVZSIYBT-UHFFFAOYSA-N
MW318.42 g/mol
LogP2.19
Rot. Bonds6

About 1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea

1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea (PubChem CID 71868395) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is 1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea.

Molecular Properties

Compound Name1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea
PubChem CID71868395
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC Name1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea
SMILESCOc1ccccc1C1(CNC(=O)NCC2CCCC2O)CC1
InChIInChI=1S/C18H26N2O3/c1-23-16-8-3-2-6-14(16)18(9-10-18)12-20-17(22)19-11-13-5-4-7-15(13)21/h2-3,6,8,13,15,21H,4-5,7,9-12H2,1H3,(H2,19,20,22)
InChIKeyXDXGSKNVZSIYBT-UHFFFAOYSA-N
XLogP2.19
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 52.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea with MolForge

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Related Compounds

1-cyclobutyl-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]-1-methylurea
CID 84585180
1-[[1-(2-methoxyphenyl)cyclopropyl]methyl]-3-(2-methylpropyl)urea
CID 60612371
methyl N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]carbamate
CID 110477745
1-[[1-(2-methoxyphenyl)cyclobutyl]methyl]-3-phenylurea
CID 110446753
1-[[1-(2-methoxyphenyl)cyclopropyl]methyl]-3-(1-methoxypropan-2-yl)urea
CID 60612373
N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyrrolidine-1-carboxamide
CID 60612311
N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]-2-oxopropanamide
CID 110478355
N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]propanamide
CID 110441312
1-(4-chlorophenyl)-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea
CID 110446815
1,1-diethyl-3-[[1-(2-methoxyphenyl)cyclopentyl]methyl]urea
CID 110445118
9-amino-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120987145
3-hydroxy-N-[[1-(2-methoxyphenyl)cyclopentyl]methyl]piperidine-1-carboxamide
CID 110903329

Frequently Asked Questions

What is the IUPAC name of 1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea?
The IUPAC name of 1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea (CID 71868395) is 1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea.
What is the SMILES notation for 1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea?
The canonical SMILES for 1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea is COc1ccccc1C1(CNC(=O)NCC2CCCC2O)CC1.
What is the InChIKey of 1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea?
The InChIKey is XDXGSKNVZSIYBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-23-16-8-3-2-6-14(16)18(9-10-18)12-20-17(22)19-11-13-5-4-7-15(13)21/h2-3,6,8,13,15,21H,4-5,7,9-12H2,1H3,(H2,19,20,22).
What are the key properties of 1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea?
1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea has a molecular weight of 318.42 g/mol, XLogP of 2.19, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-hydroxycyclopentyl)methyl]-3-[[1-(2-methoxyphenyl)cyclopropyl]methyl]urea is sourced from PubChem (CID 71868395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).