6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide

C21H27N5O2 — CID 70300541

IUPAC6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide
SMILESO=C(NC1CCNCC1)c1cccc(Nc2ccc(N3CCOCC3)cc2)n1
InChIInChI=1S/C21H27N5O2/c27-21(24-17-8-10-22-11-9-17)19-2-1-3-20(25-19)23-16-4-6-18(7-5-16)26-12-14-28-15-13-26/h1-7,17,22H,8-15H2,(H,23,25)(H,24,27)
InChIKeyUAJFYYZUDCHALB-UHFFFAOYSA-N
MW381.48 g/mol
LogP2.14
Rot. Bonds5

About 6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide

6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide (PubChem CID 70300541) has the molecular formula C21H27N5O2 and a molecular weight of 381.48 g/mol. Its IUPAC name is 6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide
PubChem CID70300541
Molecular FormulaC21H27N5O2
Molecular Weight381.48 g/mol
Exact Mass381.22
IUPAC Name6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide
SMILESO=C(NC1CCNCC1)c1cccc(Nc2ccc(N3CCOCC3)cc2)n1
InChIInChI=1S/C21H27N5O2/c27-21(24-17-8-10-22-11-9-17)19-2-1-3-20(25-19)23-16-4-6-18(7-5-16)26-12-14-28-15-13-26/h1-7,17,22H,8-15H2,(H,23,25)(H,24,27)
InChIKeyUAJFYYZUDCHALB-UHFFFAOYSA-N
XLogP2.14
TPSA78.52 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.48
LogP ≤ 52.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

6-(piperidin-4-ylcarbamoyl)pyridine-2-carboxylic acid
CID 61403349
N-cyclopropyl-2-(4-morpholin-4-ylanilino)quinoline-4-carboxamide
CID 117090375
N-cyclopropyl-6-(2-morpholin-4-ylethylamino)pyridine-2-carboxamide
CID 117081828
6-N-cyclohexyl-2-N-(4-pyrrolidin-1-ylphenyl)pyridine-2,6-dicarboxamide
CID 109095385
N-cyclopropyl-5-morpholin-4-ylpyridine-2-carboxamide
CID 109179845
N-cyclopropyl-2-methyl-6-[4-(4-methylpiperidin-1-yl)anilino]pyrimidine-4-carboxamide
CID 109361116
N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]-4-piperazin-1-ylbenzamide
CID 67112495
N-cyclohexyl-2-(4-piperidin-1-ylanilino)pyrimidine-4-carboxamide
CID 109298915
6-methyl-N-pyrrolidin-3-ylpyridine-2-carboxamide;dihydrochloride
CID 119451522
6-(methylamino)-N-(oxolan-3-yl)pyridine-2-carboxamide
CID 80715956
[6-(4-morpholin-4-ylanilino)-2,3-dihydro-1H-pyrrolo[2,3-b]pyridin-3-yl]-pyridin-3-ylmethanone
CID 70842481
2-chloro-N-[(1E)-1-(methylamino)-3-(piperidin-4-ylcarbamoyl)buta-1,3-dien-2-yl]-4-morpholin-4-ylbenzamide
CID 143609186

Frequently Asked Questions

What is the IUPAC name of 6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide?
The IUPAC name of 6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide (CID 70300541) is 6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide.
What is the SMILES notation for 6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide?
The canonical SMILES for 6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide is O=C(NC1CCNCC1)c1cccc(Nc2ccc(N3CCOCC3)cc2)n1.
What is the InChIKey of 6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide?
The InChIKey is UAJFYYZUDCHALB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N5O2/c27-21(24-17-8-10-22-11-9-17)19-2-1-3-20(25-19)23-16-4-6-18(7-5-16)26-12-14-28-15-13-26/h1-7,17,22H,8-15H2,(H,23,25)(H,24,27).
What are the key properties of 6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide?
6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide has a molecular weight of 381.48 g/mol, XLogP of 2.14, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-morpholin-4-ylanilino)-N-piperidin-4-ylpyridine-2-carboxamide is sourced from PubChem (CID 70300541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).