3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea

C10H20N2O — CID 115680560

IUPAC3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea
SMILESCN(C)C(=O)NC1CCCC1(C)C
InChIInChI=1S/C10H20N2O/c1-10(2)7-5-6-8(10)11-9(13)12(3)4/h8H,5-7H2,1-4H3,(H,11,13)
InChIKeyVNUYBUHEMIIKBV-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.84
Rot. Bonds1

About 3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea

3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea (PubChem CID 115680560) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea.

Molecular Properties

Compound Name3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea
PubChem CID115680560
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea
SMILESCN(C)C(=O)NC1CCCC1(C)C
InChIInChI=1S/C10H20N2O/c1-10(2)7-5-6-8(10)11-9(13)12(3)4/h8H,5-7H2,1-4H3,(H,11,13)
InChIKeyVNUYBUHEMIIKBV-UHFFFAOYSA-N
XLogP1.84
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2,2-dimethylcyclopentyl)-2,2-dimethylpropanamide
CID 79872163
1-[(2,2-dimethylcyclopentyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 79872847
3-[(2,2-dimethylcyclopentyl)amino]-3-oxopropanoic acid
CID 79873237
2-chloro-N-(2,2-dimethylcyclopentyl)acetamide
CID 79872044
N-(2,2-dimethylcyclopentyl)propanamide;ethane
CID 171523007
2-amino-N-(2,2-dimethylcyclohexyl)-1-methylcyclopentane-1-carboxamide
CID 82768367
4-[(2,2-dimethylcyclopentyl)carbamoylamino]-2,3-dimethyl-4-oxobut-2-enoic acid
CID 79877852
N-(2,2-dimethylcyclohexyl)-2-methyl-2-(methylamino)propanamide
CID 79878472
1-(2,2-dimethylcyclopentyl)-3-[2-(hydroxymethyl)-2-methylcyclopentyl]urea
CID 111841148
2-[cyclopropylmethyl-[(2,2-dimethylcyclohexyl)carbamoyl]amino]acetic acid
CID 79878621
N-(2,2-dimethylcyclopentyl)-2-sulfanylbutanamide
CID 131177062
3-chloro-N-(2,2-dimethylcyclopentyl)-2,2-dimethylpropanamide
CID 79871536

Frequently Asked Questions

What is the IUPAC name of 3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea?
The IUPAC name of 3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea (CID 115680560) is 3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea.
What is the SMILES notation for 3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea?
The canonical SMILES for 3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea is CN(C)C(=O)NC1CCCC1(C)C.
What is the InChIKey of 3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea?
The InChIKey is VNUYBUHEMIIKBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-10(2)7-5-6-8(10)11-9(13)12(3)4/h8H,5-7H2,1-4H3,(H,11,13).
What are the key properties of 3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea?
3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea has a molecular weight of 184.28 g/mol, XLogP of 1.84, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-dimethylcyclopentyl)-1,1-dimethylurea is sourced from PubChem (CID 115680560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).