1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea

C14H28N2O3 — CID 111426774

IUPAC1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea
SMILESCCCC1CCC(NC(=O)NCC(O)COC)CC1
InChIInChI=1S/C14H28N2O3/c1-3-4-11-5-7-12(8-6-11)16-14(18)15-9-13(17)10-19-2/h11-13,17H,3-10H2,1-2H3,(H2,15,16,18)
InChIKeyFAICPUVYNYOBRX-UHFFFAOYSA-N
MW272.39 g/mol
LogP1.65
Rot. Bonds7

About 1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea

1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea (PubChem CID 111426774) has the molecular formula C14H28N2O3 and a molecular weight of 272.39 g/mol. Its IUPAC name is 1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea.

Molecular Properties

Compound Name1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea
PubChem CID111426774
Molecular FormulaC14H28N2O3
Molecular Weight272.39 g/mol
Exact Mass272.21
IUPAC Name1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea
SMILESCCCC1CCC(NC(=O)NCC(O)COC)CC1
InChIInChI=1S/C14H28N2O3/c1-3-4-11-5-7-12(8-6-11)16-14(18)15-9-13(17)10-19-2/h11-13,17H,3-10H2,1-2H3,(H2,15,16,18)
InChIKeyFAICPUVYNYOBRX-UHFFFAOYSA-N
XLogP1.65
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 51.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-2-[[(4-propylcyclohexyl)carbamoylamino]methyl]butanoic acid
CID 65221396
1-cyclopropyl-3-[2-hydroxy-3-(2-methylpropoxy)propyl]urea
CID 55767176
1-methoxy-4-[(4-propylcyclohexyl)amino]butan-2-ol
CID 103876239
1-[2-(furan-2-yl)-2-hydroxyethyl]-3-(4-propylcyclohexyl)urea
CID 110904027
1-(cyclooctylmethyl)-3-(2-hydroxy-3-methoxypropyl)urea
CID 111426766
1-cycloheptyl-3-[(2S)-3-(cyclopropylmethoxy)-2-hydroxypropyl]urea
CID 97080512
N-cyclopropyl-2-[(2-hydroxy-3-methoxypropyl)amino]acetamide
CID 63929849
1-cyclopropyl-3-[(4-ethylcyclohexyl)methyl]urea
CID 115590484
2-[[(4-ethylcyclohexyl)carbamoylamino]methyl]-3-methylbutanoic acid
CID 65223787
ethyl N-(4-propylcyclohexyl)carbamate
CID 61381222
1-(cyclopropylamino)-3-methoxypropan-2-ol
CID 21034992
2-hydroxyethyl N-(4-propylcyclohexyl)carbamate
CID 79349163

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea?
The IUPAC name of 1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea (CID 111426774) is 1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea.
What is the SMILES notation for 1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea?
The canonical SMILES for 1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea is CCCC1CCC(NC(=O)NCC(O)COC)CC1.
What is the InChIKey of 1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea?
The InChIKey is FAICPUVYNYOBRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O3/c1-3-4-11-5-7-12(8-6-11)16-14(18)15-9-13(17)10-19-2/h11-13,17H,3-10H2,1-2H3,(H2,15,16,18).
What are the key properties of 1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea?
1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea has a molecular weight of 272.39 g/mol, XLogP of 1.65, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxy-3-methoxypropyl)-3-(4-propylcyclohexyl)urea is sourced from PubChem (CID 111426774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).