1-[(3-hydroxycyclopentyl)methyl]-3-propylurea

C10H20N2O2 — CID 103207904

IUPAC1-[(3-hydroxycyclopentyl)methyl]-3-propylurea
SMILESCCCNC(=O)NCC1CCC(O)C1
InChIInChI=1S/C10H20N2O2/c1-2-5-11-10(14)12-7-8-3-4-9(13)6-8/h8-9,13H,2-7H2,1H3,(H2,11,12,14)
InChIKeyJPCZOXDXBJUYNU-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.86
Rot. Bonds4

About 1-[(3-hydroxycyclopentyl)methyl]-3-propylurea

1-[(3-hydroxycyclopentyl)methyl]-3-propylurea (PubChem CID 103207904) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-[(3-hydroxycyclopentyl)methyl]-3-propylurea.

Molecular Properties

Compound Name1-[(3-hydroxycyclopentyl)methyl]-3-propylurea
PubChem CID103207904
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name1-[(3-hydroxycyclopentyl)methyl]-3-propylurea
SMILESCCCNC(=O)NCC1CCC(O)C1
InChIInChI=1S/C10H20N2O2/c1-2-5-11-10(14)12-7-8-3-4-9(13)6-8/h8-9,13H,2-7H2,1H3,(H2,11,12,14)
InChIKeyJPCZOXDXBJUYNU-UHFFFAOYSA-N
XLogP0.86
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-tert-butylsulfanylethyl)-3-[[(1S,3R)-3-hydroxycyclopentyl]methyl]urea
CID 99792927
1-(2-cyclohexylethyl)-3-[[(1S,3R)-3-hydroxycyclopentyl]methyl]urea
CID 99858704
methyl N-[(3-hydroxycyclopentyl)methyl]carbamate
CID 103279767
2-ethyl-N-[(3-hydroxycyclopentyl)methyl]butanamide
CID 103279737
1-[2-(3,5-dimethylphenoxy)ethyl]-3-[[(1S,3R)-3-hydroxycyclopentyl]methyl]urea
CID 99830440
2-cyclopropyl-N-[(3-hydroxycyclopentyl)methyl]acetamide
CID 103280419
N-[(3-hydroxycyclopentyl)methyl]cyclopropanecarboxamide
CID 103280320
1-[(3-hydroxycyclohexyl)methyl]-3-(4-methylsulfanylbutyl)urea
CID 111506508
1-(cyclohex-3-en-1-ylmethyl)-3-propylurea
CID 89090826
4-butyl-N-[(3-hydroxycyclopentyl)methyl]cyclohexane-1-carboxamide
CID 103280018
1-[2-(4-chlorophenoxy)ethyl]-3-[[(1S,3R)-3-hydroxycyclopentyl]methyl]urea
CID 99829031
N-[(3-hydroxycyclopentyl)methyl]-2-sulfanylacetamide
CID 106137763

Frequently Asked Questions

What is the IUPAC name of 1-[(3-hydroxycyclopentyl)methyl]-3-propylurea?
The IUPAC name of 1-[(3-hydroxycyclopentyl)methyl]-3-propylurea (CID 103207904) is 1-[(3-hydroxycyclopentyl)methyl]-3-propylurea.
What is the SMILES notation for 1-[(3-hydroxycyclopentyl)methyl]-3-propylurea?
The canonical SMILES for 1-[(3-hydroxycyclopentyl)methyl]-3-propylurea is CCCNC(=O)NCC1CCC(O)C1.
What is the InChIKey of 1-[(3-hydroxycyclopentyl)methyl]-3-propylurea?
The InChIKey is JPCZOXDXBJUYNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-2-5-11-10(14)12-7-8-3-4-9(13)6-8/h8-9,13H,2-7H2,1H3,(H2,11,12,14).
What are the key properties of 1-[(3-hydroxycyclopentyl)methyl]-3-propylurea?
1-[(3-hydroxycyclopentyl)methyl]-3-propylurea has a molecular weight of 200.28 g/mol, XLogP of 0.86, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-hydroxycyclopentyl)methyl]-3-propylurea is sourced from PubChem (CID 103207904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).