1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide

C19H21N3O3 — CID 56798532

IUPAC1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)c2ccnc(OCc3ccccc3)c2)CC1
InChIInChI=1S/C19H21N3O3/c20-18(23)15-7-10-22(11-8-15)19(24)16-6-9-21-17(12-16)25-13-14-4-2-1-3-5-14/h1-6,9,12,15H,7-8,10-11,13H2,(H2,20,23)
InChIKeyPEZQGUAYDIPRBT-UHFFFAOYSA-N
MW339.40 g/mol
LogP2.00
Rot. Bonds5

About 1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide

1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide (PubChem CID 56798532) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is 1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide
PubChem CID56798532
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC Name1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)c2ccnc(OCc3ccccc3)c2)CC1
InChIInChI=1S/C19H21N3O3/c20-18(23)15-7-10-22(11-8-15)19(24)16-6-9-21-17(12-16)25-13-14-4-2-1-3-5-14/h1-6,9,12,15H,7-8,10-11,13H2,(H2,20,23)
InChIKeyPEZQGUAYDIPRBT-UHFFFAOYSA-N
XLogP2.00
TPSA85.52 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxylate
CID 47069831
1-(6-phenylmethoxypyrimidine-4-carbonyl)piperidine-4-carboxamide
CID 91816326
1-(2-methoxypyridine-4-carbonyl)piperidine-4-carboxamide
CID 84580487
(2R,3R)-2-methyl-1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-3-carboxylic acid
CID 122116549
6-methyl-1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-3-carboxylic acid
CID 122113029
1-[3,5-dimethyl-4-(pyridin-3-ylmethoxy)benzoyl]piperidine-4-carboxamide
CID 39717853
[2-(morpholin-4-ylmethyl)piperidin-1-yl]-(2-phenylmethoxy-4-pyridinyl)methanone
CID 75463364
1-[3-(chloromethyl)benzoyl]piperidine-4-carboxamide
CID 43333364
(6R)-6-methyl-4-(2-phenylmethoxypyridine-4-carbonyl)morpholine-2-carboxylic acid
CID 120536224
1-[2-(2-phenylmethoxyphenoxy)acetyl]piperidine-4-carboxamide
CID 119125469
1-(6-phenylmethoxypyridine-3-carbonyl)pyrrolidine-3-carboxylic acid
CID 120533820
1-[3-(2-aminoethyl)benzoyl]piperidine-4-carboxamide
CID 62593665

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide (CID 56798532) is 1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)c2ccnc(OCc3ccccc3)c2)CC1.
What is the InChIKey of 1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide?
The InChIKey is PEZQGUAYDIPRBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3/c20-18(23)15-7-10-22(11-8-15)19(24)16-6-9-21-17(12-16)25-13-14-4-2-1-3-5-14/h1-6,9,12,15H,7-8,10-11,13H2,(H2,20,23).
What are the key properties of 1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide?
1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide has a molecular weight of 339.40 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenylmethoxypyridine-4-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 56798532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).