N,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide

C23H27N3O2 — CID 11211122

IUPACN,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide
SMILESCCN(CC)C(=O)c1ccc(C2=CC3(CCNCC3)Oc3ccccc32)cn1
InChIInChI=1S/C23H27N3O2/c1-3-26(4-2)22(27)20-10-9-17(16-25-20)19-15-23(11-13-24-14-12-23)28-21-8-6-5-7-18(19)21/h5-10,15-16,24H,3-4,11-14H2,1-2H3
InChIKeyGKICFSXEQRMXJB-UHFFFAOYSA-N
MW377.49 g/mol
LogP3.51
Rot. Bonds4

About N,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide

N,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide (PubChem CID 11211122) has the molecular formula C23H27N3O2 and a molecular weight of 377.49 g/mol. Its IUPAC name is N,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide
PubChem CID11211122
Molecular FormulaC23H27N3O2
Molecular Weight377.49 g/mol
Exact Mass377.21
IUPAC NameN,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide
SMILESCCN(CC)C(=O)c1ccc(C2=CC3(CCNCC3)Oc3ccccc32)cn1
InChIInChI=1S/C23H27N3O2/c1-3-26(4-2)22(27)20-10-9-17(16-25-20)19-15-23(11-13-24-14-12-23)28-21-8-6-5-7-18(19)21/h5-10,15-16,24H,3-4,11-14H2,1-2H3
InChIKeyGKICFSXEQRMXJB-UHFFFAOYSA-N
XLogP3.51
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.49
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-Methyl-N-((2-(1-(2-(methylamino)ethyl)piperidin-4-yl)pyridin-4-yl)methyl)-3-phenoxybenzamide
CID 122707126
2-Methoxy-4-[4-methyl-5-(4-piperazin-1-ylphenyl)pyridin-3-yl]benzamide
CID 139582022
5-(4-((Phenethylamino)methyl)phenoxy)picolinamide
CID 44434951
4-phenoxy-N-(pyridin-2-ylmethyl)benzamide
CID 2352168
2-((2-ethylphenyl)methoxy)-N-(pyridin-3-yl)benzamide
CID 118911741
N-{2-(4-Methoxy-phenyl)-1-[(pyridin-3-ylmethyl)-carbamoyl]-vinyl}-benzamide
CID 5442665
6-(4-(2-(Benzylamino)ethyl)phenoxy)picolinamide
CID 44434931
5-(4-Methylpiperazin-1-Yl)-2-Phenylmethoxy-~{n}-Pyridin-3-Yl-Benzamide
CID 51357515
6-Methyl-4-(2-Phenoxyphenyl)-1,6-Dihydro-7h-Pyrrolo[2,3-C]pyridin-7-One
CID 71616297
N-[(3-methoxyphenyl)methyl]-5H-[1]benzopyrano[3,4-c]pyridine-8-carboxamide
CID 121363591
N-(3-methoxy-4-methylphenyl)picolinamide
CID 44191178
N-(4-(4-(2-methoxyphenyl)piperazin-1-yl)butyl)-4-pyridin-2-ylbenzamide
CID 44427818

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide?
The IUPAC name of N,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide (CID 11211122) is N,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide.
What is the SMILES notation for N,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide?
The canonical SMILES for N,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide is CCN(CC)C(=O)c1ccc(C2=CC3(CCNCC3)Oc3ccccc32)cn1.
What is the InChIKey of N,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide?
The InChIKey is GKICFSXEQRMXJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N3O2/c1-3-26(4-2)22(27)20-10-9-17(16-25-20)19-15-23(11-13-24-14-12-23)28-21-8-6-5-7-18(19)21/h5-10,15-16,24H,3-4,11-14H2,1-2H3.
What are the key properties of N,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide?
N,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide has a molecular weight of 377.49 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-5-spiro[chromene-2,4'-piperidine]-4-ylpyridine-2-carboxamide is sourced from PubChem (CID 11211122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).