N-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide

C19H24N2O3 — CID 46353341

IUPACN-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide
SMILESO=C1CC2(CCN(C(=O)NC3CCCC3)CC2)Oc2ccccc21
InChIInChI=1S/C19H24N2O3/c22-16-13-19(24-17-8-4-3-7-15(16)17)9-11-21(12-10-19)18(23)20-14-5-1-2-6-14/h3-4,7-8,14H,1-2,5-6,9-13H2,(H,20,23)
InChIKeyPKWHHSRBCGJPKP-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.14
Rot. Bonds1

About N-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide

N-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide (PubChem CID 46353341) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is N-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide
PubChem CID46353341
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC NameN-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide
SMILESO=C1CC2(CCN(C(=O)NC3CCCC3)CC2)Oc2ccccc21
InChIInChI=1S/C19H24N2O3/c22-16-13-19(24-17-8-4-3-7-15(16)17)9-11-21(12-10-19)18(23)20-14-5-1-2-6-14/h3-4,7-8,14H,1-2,5-6,9-13H2,(H,20,23)
InChIKeyPKWHHSRBCGJPKP-UHFFFAOYSA-N
XLogP3.14
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-7,8-dimethyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide
CID 108781833
1'-(2-cyclopentylacetyl)spiro[3H-chromene-2,3'-pyrrolidine]-4-one
CID 90585833
1'-(1-acetylpiperidine-4-carbonyl)spiro[3H-chromene-2,4'-piperidine]-4-one
CID 108734267
1'-(morpholine-4-carbonyl)spiro[3H-chromene-2,4'-piperidine]-4-one
CID 126468398
1'-(2-methylpropanoyl)spiro[3H-chromene-2,4'-piperidine]-4-one
CID 7260499
1'-(2-iodobenzoyl)spiro[3H-chromene-2,4'-piperidine]-4-one
CID 108757554
2-(4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carbonyl)benzoic acid
CID 7260656
1'-(2-chlorobenzoyl)spiro[3H-chromene-2,4'-piperidine]-4-one
CID 7260534
N-(2-chlorophenyl)-4-oxospiro[3H-chromene-2,3'-pyrrolidine]-1'-carboxamide
CID 90586080
(4R)-N-cyclopentyl-4-[2-(cyclopropylamino)-2-oxoethyl]spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-carboxamide
CID 97401154
N-[(3R,4R)-4-methoxyoxolan-3-yl]-4-oxospiro[3H-chromene-2,3'-pyrrolidine]-1'-carboxamide
CID 164635737
[2-oxo-2-(4-oxospiro[3H-chromene-2,4'-azepane]-1'-yl)ethyl]urea
CID 164695148

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide?
The IUPAC name of N-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide (CID 46353341) is N-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide?
The canonical SMILES for N-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide is O=C1CC2(CCN(C(=O)NC3CCCC3)CC2)Oc2ccccc21.
What is the InChIKey of N-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide?
The InChIKey is PKWHHSRBCGJPKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c22-16-13-19(24-17-8-4-3-7-15(16)17)9-11-21(12-10-19)18(23)20-14-5-1-2-6-14/h3-4,7-8,14H,1-2,5-6,9-13H2,(H,20,23).
What are the key properties of N-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide?
N-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide has a molecular weight of 328.41 g/mol, XLogP of 3.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxamide is sourced from PubChem (CID 46353341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).