N-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide

C14H27N3O2 — CID 78924950

IUPACN-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide
SMILESCC(C)(O)CN1CCN(C(=O)NC2CCCC2)CC1
InChIInChI=1S/C14H27N3O2/c1-14(2,19)11-16-7-9-17(10-8-16)13(18)15-12-5-3-4-6-12/h12,19H,3-11H2,1-2H3,(H,15,18)
InChIKeyXWCKBVYVSQJMHM-UHFFFAOYSA-N
MW269.39 g/mol
LogP1.03
Rot. Bonds3

About N-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide

N-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide (PubChem CID 78924950) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide
PubChem CID78924950
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC NameN-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide
SMILESCC(C)(O)CN1CCN(C(=O)NC2CCCC2)CC1
InChIInChI=1S/C14H27N3O2/c1-14(2,19)11-16-7-9-17(10-8-16)13(18)15-12-5-3-4-6-12/h12,19H,3-11H2,1-2H3,(H,15,18)
InChIKeyXWCKBVYVSQJMHM-UHFFFAOYSA-N
XLogP1.03
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-amino-2-methylpropyl)-N-cyclohexylpiperazine-1-carboxamide
CID 120847763
N-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carbothioamide
CID 116508807
N-cycloheptyl-4-ethylpiperazine-1-carboxamide
CID 108988502
3-[4-(cycloheptylcarbamoyl)piperazin-1-yl]propanoic acid
CID 61194091
methyl 3-[4-(cyclopentylcarbamoyl)piperazin-1-yl]propanoate
CID 78973033
N-cycloheptylpiperidine-1-carboxamide
CID 54054704
3-[4-(cyclohexylcarbamoyl)-1,4-diazepan-1-yl]propanoic acid
CID 82322944
4-(1-amino-2-methylpropan-2-yl)-N-cyclobutylpiperazine-1-carboxamide
CID 116658140
N-cycloheptyl-4-[3-(dimethylamino)propyl]piperazine-1-carboxamide
CID 113106139
N-cyclohexyl-4-(4-ethylpiperazine-1-carbonyl)piperidine-1-carboxamide
CID 113003723
4-(2-cyanopropan-2-yl)-N-cyclohexylpiperazine-1-carboxamide
CID 60681900
4-acetamido-N-cyclopentylpiperidine-1-carboxamide
CID 49468459

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide?
The IUPAC name of N-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide (CID 78924950) is N-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide?
The canonical SMILES for N-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide is CC(C)(O)CN1CCN(C(=O)NC2CCCC2)CC1.
What is the InChIKey of N-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide?
The InChIKey is XWCKBVYVSQJMHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-14(2,19)11-16-7-9-17(10-8-16)13(18)15-12-5-3-4-6-12/h12,19H,3-11H2,1-2H3,(H,15,18).
What are the key properties of N-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide?
N-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-(2-hydroxy-2-methylpropyl)piperazine-1-carboxamide is sourced from PubChem (CID 78924950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).