1-(2-hydroxypropyl)-3-propylurea

C7H16N2O2 — CID 12876542

IUPAC1-(2-hydroxypropyl)-3-propylurea
SMILESCCCNC(=O)NCC(C)O
InChIInChI=1S/C7H16N2O2/c1-3-4-8-7(11)9-5-6(2)10/h6,10H,3-5H2,1-2H3,(H2,8,9,11)
InChIKeyUUSSTBFLCYYYKK-UHFFFAOYSA-N
MW160.22 g/mol
LogP0.08
Rot. Bonds4

About 1-(2-hydroxypropyl)-3-propylurea

1-(2-hydroxypropyl)-3-propylurea (PubChem CID 12876542) has the molecular formula C7H16N2O2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 1-(2-hydroxypropyl)-3-propylurea.

Molecular Properties

Compound Name1-(2-hydroxypropyl)-3-propylurea
PubChem CID12876542
Molecular FormulaC7H16N2O2
Molecular Weight160.22 g/mol
Exact Mass160.12
IUPAC Name1-(2-hydroxypropyl)-3-propylurea
SMILESCCCNC(=O)NCC(C)O
InChIInChI=1S/C7H16N2O2/c1-3-4-8-7(11)9-5-6(2)10/h6,10H,3-5H2,1-2H3,(H2,8,9,11)
InChIKeyUUSSTBFLCYYYKK-UHFFFAOYSA-N
XLogP0.08
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 50.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-hexyl-3-(2-hydroxypropyl)urea
CID 137320550
1-(3-ethyl-2-hydroxypentyl)-3-propylurea
CID 103657880
1-(2-methyl-3-methylsulfanylpropyl)-3-propylurea
CID 115624328
1-[(2S)-2-hydroxypropyl]-3-propylthiourea
CID 131211878
2-[[(2S)-2-hydroxypropyl]amino]-N-propylacetamide
CID 106931868
tert-butyl N-[2-(2-hydroxypropylcarbamoylamino)ethyl]carbamate
CID 108864438
1-(2-piperidin-1-ylpropyl)-3-propylurea
CID 115589371
1-(2-aminopropyl)-3-butylurea
CID 63733148
2,3-dihydroxy-N,N'-dipropylbutanediamide
CID 13226339
2-methyl-3-[[2-oxo-2-(propylamino)ethyl]carbamoylamino]propanoic acid
CID 62669389
N-propyl-2-(propylcarbamoylamino)acetamide
CID 115571904
1-propyl-3-tridecylurea
CID 10934987

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxypropyl)-3-propylurea?
The IUPAC name of 1-(2-hydroxypropyl)-3-propylurea (CID 12876542) is 1-(2-hydroxypropyl)-3-propylurea.
What is the SMILES notation for 1-(2-hydroxypropyl)-3-propylurea?
The canonical SMILES for 1-(2-hydroxypropyl)-3-propylurea is CCCNC(=O)NCC(C)O.
What is the InChIKey of 1-(2-hydroxypropyl)-3-propylurea?
The InChIKey is UUSSTBFLCYYYKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2/c1-3-4-8-7(11)9-5-6(2)10/h6,10H,3-5H2,1-2H3,(H2,8,9,11).
What are the key properties of 1-(2-hydroxypropyl)-3-propylurea?
1-(2-hydroxypropyl)-3-propylurea has a molecular weight of 160.22 g/mol, XLogP of 0.08, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxypropyl)-3-propylurea is sourced from PubChem (CID 12876542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).