1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea

C11H20N2O2 — CID 103975410

IUPAC1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea
SMILESO=C(NCCC1CCCCO1)NC1CC1
InChIInChI=1S/C11H20N2O2/c14-11(13-9-4-5-9)12-7-6-10-3-1-2-8-15-10/h9-10H,1-8H2,(H2,12,13,14)
InChIKeyRLNUFUVKNLPEET-UHFFFAOYSA-N
MW212.29 g/mol
LogP1.41
Rot. Bonds4

About 1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea

1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea (PubChem CID 103975410) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea.

Molecular Properties

Compound Name1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea
PubChem CID103975410
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea
SMILESO=C(NCCC1CCCCO1)NC1CC1
InChIInChI=1S/C11H20N2O2/c14-11(13-9-4-5-9)12-7-6-10-3-1-2-8-15-10/h9-10H,1-8H2,(H2,12,13,14)
InChIKeyRLNUFUVKNLPEET-UHFFFAOYSA-N
XLogP1.41
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-3-[[(2R)-oxolan-2-yl]methyl]urea
CID 129365048
1-cyclohexyl-3-(oxolan-2-ylmethyl)urea
CID 2886315
1-cyclooctyl-3-(oxolan-2-ylmethyl)urea
CID 75865148
2-[2-(oxolan-2-yl)ethylcarbamoylamino]cyclopentane-1-carboxylic acid
CID 64815766
1-[(2-hydroxycyclohexyl)methyl]-3-[2-(oxan-2-yl)ethyl]urea
CID 110025016
1-[(3R)-1-cyclopentylpyrrolidin-3-yl]-3-[3-[(2R)-oxan-2-yl]propyl]urea
CID 99854860
N-[2-(oxan-2-yl)ethyl]cyclopropanamine
CID 62548830
(2S)-2-[2-(oxan-2-yl)ethylcarbamoylamino]butanoic acid
CID 114135764
N-[2-(oxan-2-yl)ethyl]bicyclo[3.1.0]hexane-3-carboxamide
CID 106000950
1-(2-cyclopropyl-1-hydroxypropan-2-yl)-3-[2-(oxan-2-yl)ethyl]urea
CID 110025019
3-(oxan-2-ylmethylcarbamoylamino)cyclopentane-1-carboxylic acid
CID 66032045
1-(2-methylprop-2-enyl)-3-[2-(oxolan-2-yl)ethyl]urea
CID 91661489

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea?
The IUPAC name of 1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea (CID 103975410) is 1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea.
What is the SMILES notation for 1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea?
The canonical SMILES for 1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea is O=C(NCCC1CCCCO1)NC1CC1.
What is the InChIKey of 1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea?
The InChIKey is RLNUFUVKNLPEET-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c14-11(13-9-4-5-9)12-7-6-10-3-1-2-8-15-10/h9-10H,1-8H2,(H2,12,13,14).
What are the key properties of 1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea?
1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea has a molecular weight of 212.29 g/mol, XLogP of 1.41, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-[2-(oxan-2-yl)ethyl]urea is sourced from PubChem (CID 103975410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).