1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea

C8H16N2O — CID 130688362

IUPAC1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea
SMILESCCCNC(=O)N[C@@H]1C[C@H]1C
InChIInChI=1S/C8H16N2O/c1-3-4-9-8(11)10-7-5-6(7)2/h6-7H,3-5H2,1-2H3,(H2,9,10,11)/t6-,7-/m1/s1
InChIKeyRZEUQZWSWMQQRE-RNFRBKRXSA-N
MW156.23 g/mol
LogP1.10
Rot. Bonds3

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

1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea (PubChem CID 130688362) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea.

Molecular Properties

Compound Name1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea
PubChem CID130688362
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea
SMILESCCCNC(=O)N[C@@H]1C[C@H]1C
InChIInChI=1S/C8H16N2O/c1-3-4-9-8(11)10-7-5-6(7)2/h6-7H,3-5H2,1-2H3,(H2,9,10,11)/t6-,7-/m1/s1
InChIKeyRZEUQZWSWMQQRE-RNFRBKRXSA-N
XLogP1.10
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-methylcycloheptyl)-3-propylurea
CID 115660989
1-(2-cyclopropylethyl)-3-[(1R,2R)-2-methylcyclopropyl]urea
CID 166248887
1-cyclopentyl-3-propylurea
CID 14343339
1-(2-aminocycloheptyl)-3-propylurea
CID 63258563
1-[2-(hydroxymethyl)cyclohexyl]-3-propylurea
CID 103722438
cis-(1R,2S)-2-methyl-N-propylcyclopropane-1-carboxamide
CID 95357811
1-propyl-3-(3-tricyclo[3.2.1.02,4]octanyl)urea
CID 103793569
2,2-dimethyl-3-[(2-methylcyclopropyl)carbamoylamino]propanoic acid
CID 115428743
1-(2,4-dimethylcyclohexyl)-3-ethylurea
CID 115626414
2,2,3-trimethyl-4-(propylcarbamoylamino)cyclohexane-1-carboxylic acid
CID 102627697
1-amino-3-(2-methylcyclopropyl)urea
CID 62408837
1-(2-methyloxan-4-yl)-3-propylurea
CID 103887319

Frequently Asked Questions

What is the IUPAC name of 1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea?
The IUPAC name of 1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea (CID 130688362) is 1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea.
What is the SMILES notation for 1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea?
The canonical SMILES for 1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea is CCCNC(=O)N[C@@H]1C[C@H]1C.
What is the InChIKey of 1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea?
The InChIKey is RZEUQZWSWMQQRE-RNFRBKRXSA-N. The full InChI is InChI=1S/C8H16N2O/c1-3-4-9-8(11)10-7-5-6(7)2/h6-7H,3-5H2,1-2H3,(H2,9,10,11)/t6-,7-/m1/s1.
What are the key properties of 1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea?
1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea has a molecular weight of 156.23 g/mol, XLogP of 1.10, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R,2R)-2-methylcyclopropyl]-3-propylurea is sourced from PubChem (CID 130688362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).