4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide

C23H35N3O2 — CID 91919099

IUPAC4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
SMILESCN(Cc1ccccc1)C1CCOC2(CCN(C(=O)NC3CCCC3)CC2)C1
InChIInChI=1S/C23H35N3O2/c1-25(18-19-7-3-2-4-8-19)21-11-16-28-23(17-21)12-14-26(15-13-23)22(27)24-20-9-5-6-10-20/h2-4,7-8,20-21H,5-6,9-18H2,1H3,(H,24,27)
InChIKeyGZWYDACQALIZNZ-UHFFFAOYSA-N
MW385.55 g/mol
LogP3.78
Rot. Bonds4

About 4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide

4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide (PubChem CID 91919099) has the molecular formula C23H35N3O2 and a molecular weight of 385.55 g/mol. Its IUPAC name is 4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide.

Molecular Properties

Compound Name4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
PubChem CID91919099
Molecular FormulaC23H35N3O2
Molecular Weight385.55 g/mol
Exact Mass385.27
IUPAC Name4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
SMILESCN(Cc1ccccc1)C1CCOC2(CCN(C(=O)NC3CCCC3)CC2)C1
InChIInChI=1S/C23H35N3O2/c1-25(18-19-7-3-2-4-8-19)21-11-16-28-23(17-21)12-14-26(15-13-23)22(27)24-20-9-5-6-10-20/h2-4,7-8,20-21H,5-6,9-18H2,1H3,(H,24,27)
InChIKeyGZWYDACQALIZNZ-UHFFFAOYSA-N
XLogP3.78
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.55
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide 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

Ethyl 3-({4-[(4-methylpiperidin-1-YL)methyl]piperidine-1-carbonyl}amino)-3-phenylpropanoate
CID 16033520
1-N-benzyl-4-N-(oxan-4-yl)piperidine-1,4-dicarboxamide
CID 70686704
N-cyclopentyl-4-[cyclopropyl(4-fluorobenzyl)amino]-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
CID 91919148
4-methoxy-N-phenethyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
CID 91907692
(3R*,4R*)-N-(2-fluorobenzyl)-4-hydroxy-3-methyl-4-(tetrahydro-2H-pyran-4-yl)-1-piperidinecarboxamide
CID 72846157
N-(4-fluorobenzyl)-4-methoxy-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
CID 91907686
4-[Benzyl(methyl)amino]-N-[(4-fluorophenyl)methyl]-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
CID 91908259
4-(N-Cyclopropylacetamido)-N-[(4-fluorophenyl)methyl]-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
CID 91909245
4-{1-Cyclopropyl[(propan-2-YL)carbamoyl]amino}-N-[(4-fluorophenyl)methyl]-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
CID 91909286
1-[1-[(3-Fluorophenyl)methyl]piperidin-4-yl]-1-(oxan-4-yl)-3-(2-phenylethyl)urea
CID 91916290
4-(cyclopropylmethoxy)-N-[(4-fluorophenyl)methyl]-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
CID 91917999
N-[(4-Fluorophenyl)methyl]-4-(2-methoxyethoxy)-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide
CID 91918125

Frequently Asked Questions

What is the IUPAC name of 4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide?
The IUPAC name of 4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide (CID 91919099) is 4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide.
What is the SMILES notation for 4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide?
The canonical SMILES for 4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide is CN(Cc1ccccc1)C1CCOC2(CCN(C(=O)NC3CCCC3)CC2)C1.
What is the InChIKey of 4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide?
The InChIKey is GZWYDACQALIZNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H35N3O2/c1-25(18-19-7-3-2-4-8-19)21-11-16-28-23(17-21)12-14-26(15-13-23)22(27)24-20-9-5-6-10-20/h2-4,7-8,20-21H,5-6,9-18H2,1H3,(H,24,27).
What are the key properties of 4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide?
4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide has a molecular weight of 385.55 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[benzyl(methyl)amino]-N-cyclopentyl-1-oxa-9-azaspiro[5.5]undecane-9-carboxamide is sourced from PubChem (CID 91919099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).