1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea

C10H18N2O — CID 166248887

IUPAC1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea
SMILESC[C@@H]1C[C@H]1NC(=O)NCCC1CC1
InChIInChI=1S/C10H18N2O/c1-7-6-9(7)12-10(13)11-5-4-8-2-3-8/h7-9H,2-6H2,1H3,(H2,11,12,13)/t7-,9-/m1/s1
InChIKeyXCEQQIPBZJBBBY-VXNVDRBHSA-N
MW182.27 g/mol
LogP1.49
Rot. Bonds4

About 1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea

1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea (PubChem CID 166248887) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea.

Molecular Properties

Compound Name1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea
PubChem CID166248887
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea
SMILESC[C@@H]1C[C@H]1NC(=O)NCCC1CC1
InChIInChI=1S/C10H18N2O/c1-7-6-9(7)12-10(13)11-5-4-8-2-3-8/h7-9H,2-6H2,1H3,(H2,11,12,13)/t7-,9-/m1/s1
InChIKeyXCEQQIPBZJBBBY-VXNVDRBHSA-N
XLogP1.49
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea
CID 130688362
1,3-bis(2-cyclopropylethyl)urea
CID 68635931
3-(2-cyclopropylethylcarbamoylamino)cyclopentane-1-carboxylic acid
CID 66032847
1-[4-(hydroxymethyl)cyclohexyl]-3-[2-(3-methylcyclopentyl)ethyl]urea
CID 167834563
1-(2-cyclopropylethyl)-3-methoxyurea
CID 131224486
2,2-dimethyl-3-[(2-methylcyclopropyl)carbamoylamino]propanoic acid
CID 115428743
cis-(1R,3S)-3-[2-(1-methylpiperidin-4-yl)ethylcarbamoylamino]cyclopentane-1-carboxylic acid
CID 106320196
(2S,4S)-N-(2-cyclopropylethyl)-2-methylpiperidine-4-carboxamide
CID 120633867
1-(2-cyclobutylethyl)-3-propylurea
CID 115686559
2-methyl-1-(2-methylcyclopropyl)-3-[2-(1-methylpiperidin-4-yl)ethyl]guanidine
CID 111961641
1-amino-3-(2-methylcyclopropyl)urea
CID 62408837
1-(2-methylcycloheptyl)-3-propylurea
CID 115660989

Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea?
The IUPAC name of 1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea (CID 166248887) is 1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea.
What is the SMILES notation for 1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea?
The canonical SMILES for 1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea is C[C@@H]1C[C@H]1NC(=O)NCCC1CC1.
What is the InChIKey of 1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea?
The InChIKey is XCEQQIPBZJBBBY-VXNVDRBHSA-N. The full InChI is InChI=1S/C10H18N2O/c1-7-6-9(7)12-10(13)11-5-4-8-2-3-8/h7-9H,2-6H2,1H3,(H2,11,12,13)/t7-,9-/m1/s1.
What are the key properties of 1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea?
1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea has a molecular weight of 182.27 g/mol, XLogP of 1.49, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea is sourced from PubChem (CID 166248887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).