1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea

C12H23N3O — CID 107585278

IUPAC1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea
SMILESCC1CNCC(NC(=O)NC2CCCC2)C1
InChIInChI=1S/C12H23N3O/c1-9-6-11(8-13-7-9)15-12(16)14-10-4-2-3-5-10/h9-11,13H,2-8H2,1H3,(H2,14,15,16)
InChIKeyLNSKMUZCXRBHPY-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.23
Rot. Bonds2

About 1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea

1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea (PubChem CID 107585278) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea.

Molecular Properties

Compound Name1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea
PubChem CID107585278
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea
SMILESCC1CNCC(NC(=O)NC2CCCC2)C1
InChIInChI=1S/C12H23N3O/c1-9-6-11(8-13-7-9)15-12(16)14-10-4-2-3-5-10/h9-11,13H,2-8H2,1H3,(H2,14,15,16)
InChIKeyLNSKMUZCXRBHPY-UHFFFAOYSA-N
XLogP1.23
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-methylpiperidin-3-yl)cyclopropanecarboxamide
CID 173311262
2-methyl-N-(5-methylpiperidin-3-yl)propanamide
CID 107585162
1-cyclohexyl-3-[(3S)-pyrrolidin-3-yl]urea
CID 79685110
1-cyclobutyl-3-pyrrolidin-3-ylurea
CID 116658204
1-cyclobutyl-3-(4-methylcyclohexyl)urea
CID 103653458
2,2-dimethyl-N-(5-methylpiperidin-3-yl)cyclopentane-1-carboxamide
CID 107585034
1-cyclopropyl-3-piperidin-3-ylurea
CID 62699673
1-cyclobutyl-3-cyclohexylurea
CID 17217147
2-methyl-N-(5-methylpiperidin-3-yl)oxolane-3-carboxamide
CID 107585114
3,3,3-trifluoro-N-(5-methylpiperidin-3-yl)propanamide
CID 107585044
1-(5-methylpiperidin-3-yl)-3-[4-(trifluoromethyl)phenyl]urea
CID 107585253
N-(5-methylpiperidin-3-yl)-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 107585035

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea?
The IUPAC name of 1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea (CID 107585278) is 1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea.
What is the SMILES notation for 1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea?
The canonical SMILES for 1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea is CC1CNCC(NC(=O)NC2CCCC2)C1.
What is the InChIKey of 1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea?
The InChIKey is LNSKMUZCXRBHPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-9-6-11(8-13-7-9)15-12(16)14-10-4-2-3-5-10/h9-11,13H,2-8H2,1H3,(H2,14,15,16).
What are the key properties of 1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea?
1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea has a molecular weight of 225.34 g/mol, XLogP of 1.23, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(5-methylpiperidin-3-yl)urea is sourced from PubChem (CID 107585278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).