1,1-diethyl-3-(2-methylcyclopentyl)urea

C11H22N2O — CID 115613954

IUPAC1,1-diethyl-3-(2-methylcyclopentyl)urea
SMILESCCN(CC)C(=O)NC1CCCC1C
InChIInChI=1S/C11H22N2O/c1-4-13(5-2)11(14)12-10-8-6-7-9(10)3/h9-10H,4-8H2,1-3H3,(H,12,14)
InChIKeyZFUDAIQNNIQHRR-UHFFFAOYSA-N
MW198.31 g/mol
LogP2.23
Rot. Bonds3

About 1,1-diethyl-3-(2-methylcyclopentyl)urea

1,1-diethyl-3-(2-methylcyclopentyl)urea (PubChem CID 115613954) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1,1-diethyl-3-(2-methylcyclopentyl)urea.

Molecular Properties

Compound Name1,1-diethyl-3-(2-methylcyclopentyl)urea
PubChem CID115613954
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1,1-diethyl-3-(2-methylcyclopentyl)urea
SMILESCCN(CC)C(=O)NC1CCCC1C
InChIInChI=1S/C11H22N2O/c1-4-13(5-2)11(14)12-10-8-6-7-9(10)3/h9-10H,4-8H2,1-3H3,(H,12,14)
InChIKeyZFUDAIQNNIQHRR-UHFFFAOYSA-N
XLogP2.23
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[carboxymethyl-[(2-methylcyclopentyl)carbamoyl]amino]acetic acid
CID 63644996
3-(2,4-dimethylcyclohexyl)-1,1-diethylurea
CID 115625378
1,1-diethyl-3-(2-methoxycyclopentyl)urea
CID 115693925
1-[2-(dimethylamino)ethyl]-3-(2-methylcyclohexyl)-1-(2-methylpropyl)urea
CID 86999337
(2-methylcyclopentyl)urea
CID 63281869
2-bromo-N-(2-methylcyclopentyl)acetamide
CID 63681266
3-(2,4-dimethylcyclohexyl)-1-ethyl-1-(2-hydroxyethyl)urea
CID 111123429
2-[(2,4-dimethylcyclohexyl)carbamoyl-ethylamino]acetic acid
CID 63997172
1-ethyl-3-(2-methylcyclohexyl)urea
CID 112682943
N-(2-methylcyclohexyl)butanamide
CID 47005567
2-amino-N-(2-methylcyclopentyl)butanamide
CID 63281650
2-[(2-amino-2-oxoethyl)-[(2,3-dimethylcyclohexyl)carbamoyl]amino]acetic acid
CID 107437733

Frequently Asked Questions

What is the IUPAC name of 1,1-diethyl-3-(2-methylcyclopentyl)urea?
The IUPAC name of 1,1-diethyl-3-(2-methylcyclopentyl)urea (CID 115613954) is 1,1-diethyl-3-(2-methylcyclopentyl)urea.
What is the SMILES notation for 1,1-diethyl-3-(2-methylcyclopentyl)urea?
The canonical SMILES for 1,1-diethyl-3-(2-methylcyclopentyl)urea is CCN(CC)C(=O)NC1CCCC1C.
What is the InChIKey of 1,1-diethyl-3-(2-methylcyclopentyl)urea?
The InChIKey is ZFUDAIQNNIQHRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-4-13(5-2)11(14)12-10-8-6-7-9(10)3/h9-10H,4-8H2,1-3H3,(H,12,14).
What are the key properties of 1,1-diethyl-3-(2-methylcyclopentyl)urea?
1,1-diethyl-3-(2-methylcyclopentyl)urea has a molecular weight of 198.31 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-diethyl-3-(2-methylcyclopentyl)urea is sourced from PubChem (CID 115613954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).