1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea

C12H23N3O — CID 52722382

IUPAC1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea
SMILESCN1CCC[C@@H](NC(=O)NC2CCCC2)C1
InChIInChI=1S/C12H23N3O/c1-15-8-4-7-11(9-15)14-12(16)13-10-5-2-3-6-10/h10-11H,2-9H2,1H3,(H2,13,14,16)/t11-/m1/s1
InChIKeyVRVVNOVYLDMNBM-LLVKDONJSA-N
MW225.34 g/mol
LogP1.32
Rot. Bonds2

About 1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea

1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea (PubChem CID 52722382) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea.

Molecular Properties

Compound Name1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea
PubChem CID52722382
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea
SMILESCN1CCC[C@@H](NC(=O)NC2CCCC2)C1
InChIInChI=1S/C12H23N3O/c1-15-8-4-7-11(9-15)14-12(16)13-10-5-2-3-6-10/h10-11H,2-9H2,1H3,(H2,13,14,16)/t11-/m1/s1
InChIKeyVRVVNOVYLDMNBM-LLVKDONJSA-N
XLogP1.32
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclohexylpiperazine-1-carboxamide hydrochloride
CID 24746865
N-[2-(diethylamino)ethyl](cyclohexylamino)carboxamide
CID 2054543
N-cyclohexyl-4-methylpiperazine-1-carboxamide
CID 306772
N-butyl-N'-cyclopentylurea
CID 4150224
1-Cyclohexyl-3-[2-(dimethylamino)ethyl]urea
CID 876098
N-(1-Cyclohexylpyrrolidin-3-yl)-N'-propan-2-ylcarbamimidic acid
CID 209545
1-[2-(Piperazin-1-yl)ethyl]-3-(propan-2-yl)urea
CID 43600356
1-(Piperidin-4-yl)imidazolidin-2-one hydrochloride
CID 13031758
N-(propan-2-yl)piperazine-1-carboxamide hydrochloride
CID 17811303
1-(2-(Piperidin-1-yl)ethyl)imidazolidin-2-one
CID 17987132
1-Piperidinecarboxamide, 3-amino-N,N-dimethyl-
CID 21482877
1-(Piperidin-3-yl)imidazolidin-2-one
CID 45791720

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea?
The IUPAC name of 1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea (CID 52722382) is 1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea.
What is the SMILES notation for 1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea?
The canonical SMILES for 1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea is CN1CCC[C@@H](NC(=O)NC2CCCC2)C1.
What is the InChIKey of 1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea?
The InChIKey is VRVVNOVYLDMNBM-LLVKDONJSA-N. The full InChI is InChI=1S/C12H23N3O/c1-15-8-4-7-11(9-15)14-12(16)13-10-5-2-3-6-10/h10-11H,2-9H2,1H3,(H2,13,14,16)/t11-/m1/s1.
What are the key properties of 1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea?
1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea has a molecular weight of 225.34 g/mol, XLogP of 1.32, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-[(3R)-1-methylpiperidin-3-yl]urea is sourced from PubChem (CID 52722382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).