1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide

C22H28N4O2 — CID 55986688

IUPAC1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)nc1)C1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C22H28N4O2/c27-22(19-7-4-10-25(17-19)16-18-5-2-1-3-6-18)24-20-8-9-21(23-15-20)26-11-13-28-14-12-26/h1-3,5-6,8-9,15,19H,4,7,10-14,16-17H2,(H,24,27)
InChIKeyHYZNBVSEPLEQNY-UHFFFAOYSA-N
MW380.49 g/mol
LogP2.77
Rot. Bonds5

About 1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide

1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide (PubChem CID 55986688) has the molecular formula C22H28N4O2 and a molecular weight of 380.49 g/mol. Its IUPAC name is 1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide
PubChem CID55986688
Molecular FormulaC22H28N4O2
Molecular Weight380.49 g/mol
Exact Mass380.22
IUPAC Name1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc(N2CCOCC2)nc1)C1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C22H28N4O2/c27-22(19-7-4-10-25(17-19)16-18-5-2-1-3-6-18)24-20-8-9-21(23-15-20)26-11-13-28-14-12-26/h1-3,5-6,8-9,15,19H,4,7,10-14,16-17H2,(H,24,27)
InChIKeyHYZNBVSEPLEQNY-UHFFFAOYSA-N
XLogP2.77
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-benzyl-N-(6-pyrazol-1-yl-3-pyridinyl)piperidine-3-carboxamide
CID 47804635
1-benzyl-N-(3,4-dichlorophenyl)piperidine-3-carboxamide
CID 43925060
1-benzyl-N-(4-phenylmethoxyphenyl)piperidine-3-carboxamide
CID 43922210
N-(6-piperidin-1-yl-3-pyridinyl)oxane-4-carboxamide
CID 30179936
(3S)-1-benzyl-N-(4-phenoxyphenyl)piperidine-3-carboxamide
CID 93490714
1-benzyl-N-(4-phenoxyphenyl)piperidine-3-carboxamide
CID 43919796
N-[6-(4-benzylpiperidin-1-yl)-3-pyridinyl]cyclopropanecarboxamide
CID 113015446
1-benzyl-N-[[4-(morpholin-4-ylmethyl)phenyl]methyl]piperidine-3-carboxamide
CID 43917296
(3S)-1-benzyl-N-(3,4-dimethylphenyl)piperidine-3-carboxamide
CID 93490442
1-benzyl-N-(5-chloro-2-pyridinyl)piperidine-3-carboxamide
CID 60565468
(3R)-1-benzyl-N-(3-chlorophenyl)piperidine-3-carboxamide
CID 93490525
(3S)-1-benzyl-N-(3-chlorophenyl)piperidine-3-carboxamide
CID 93490524

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide?
The IUPAC name of 1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide (CID 55986688) is 1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide?
The canonical SMILES for 1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide is O=C(Nc1ccc(N2CCOCC2)nc1)C1CCCN(Cc2ccccc2)C1.
What is the InChIKey of 1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide?
The InChIKey is HYZNBVSEPLEQNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O2/c27-22(19-7-4-10-25(17-19)16-18-5-2-1-3-6-18)24-20-8-9-21(23-15-20)26-11-13-28-14-12-26/h1-3,5-6,8-9,15,19H,4,7,10-14,16-17H2,(H,24,27).
What are the key properties of 1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide?
1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide has a molecular weight of 380.49 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(6-morpholin-4-yl-3-pyridinyl)piperidine-3-carboxamide is sourced from PubChem (CID 55986688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).