2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide

C16H24N4O2 — CID 71996494

IUPAC2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide
SMILESNC(=O)c1ccnc(N2CCCC(CN3CCOCC3)C2)c1
InChIInChI=1S/C16H24N4O2/c17-16(21)14-3-4-18-15(10-14)20-5-1-2-13(12-20)11-19-6-8-22-9-7-19/h3-4,10,13H,1-2,5-9,11-12H2,(H2,17,21)
InChIKeyISTRPHWXJJVNMW-UHFFFAOYSA-N
MW304.39 g/mol
LogP0.73
Rot. Bonds4

About 2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide

2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide (PubChem CID 71996494) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide
PubChem CID71996494
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC Name2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide
SMILESNC(=O)c1ccnc(N2CCCC(CN3CCOCC3)C2)c1
InChIInChI=1S/C16H24N4O2/c17-16(21)14-3-4-18-15(10-14)20-5-1-2-13(12-20)11-19-6-8-22-9-7-19/h3-4,10,13H,1-2,5-9,11-12H2,(H2,17,21)
InChIKeyISTRPHWXJJVNMW-UHFFFAOYSA-N
XLogP0.73
TPSA71.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[[(3S)-1-(4-bromo-2-pyridinyl)piperidin-3-yl]methyl]morpholine
CID 99855918
2-[(3R)-3-[(4-methylphenoxy)methyl]piperidin-1-yl]pyridine-4-carboxamide
CID 97274690
methyl 6-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridazine-3-carboxylate
CID 133322299
4-bromo-2-fluoro-6-[3-(morpholin-4-ylmethyl)piperidin-1-yl]benzamide
CID 133441512
4-[[1-(4-pyrrolidin-1-ylpyrimidin-2-yl)piperidin-3-yl]methyl]morpholine
CID 75422646
4-[[(3S)-1-(4-pyrrolidin-1-ylpyrimidin-2-yl)piperidin-3-yl]methyl]morpholine
CID 97318478
2-[4-[(3S)-3-(morpholine-4-carbonyl)piperidin-1-yl]piperidin-1-yl]pyridine-4-carboxamide
CID 95524873
2-[2-(aminomethyl)morpholin-4-yl]pyridine-4-carboxamide
CID 114399474
4-[[(3R)-1-quinoxalin-2-ylpiperidin-3-yl]methyl]morpholine
CID 95624715
6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-3-carbonitrile
CID 95624717
methyl 3-methyl-6-[(3R)-3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-2-carboxylate
CID 167829544
4-[[1-(6-chloro-2-methylpyrimidin-4-yl)piperidin-3-yl]methyl]morpholine
CID 133302102

Frequently Asked Questions

What is the IUPAC name of 2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide?
The IUPAC name of 2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide (CID 71996494) is 2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide.
What is the SMILES notation for 2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide?
The canonical SMILES for 2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide is NC(=O)c1ccnc(N2CCCC(CN3CCOCC3)C2)c1.
What is the InChIKey of 2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide?
The InChIKey is ISTRPHWXJJVNMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c17-16(21)14-3-4-18-15(10-14)20-5-1-2-13(12-20)11-19-6-8-22-9-7-19/h3-4,10,13H,1-2,5-9,11-12H2,(H2,17,21).
What are the key properties of 2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide?
2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide has a molecular weight of 304.39 g/mol, XLogP of 0.73, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(morpholin-4-ylmethyl)piperidin-1-yl]pyridine-4-carboxamide is sourced from PubChem (CID 71996494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).