(3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide

C17H24N4O3 — CID 95585110

IUPAC(3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide
SMILESC[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C17H24N4O3/c1-12-2-3-14(16(18)22)11-21(12)17(23)13-4-5-15(19-10-13)20-6-8-24-9-7-20/h4-5,10,12,14H,2-3,6-9,11H2,1H3,(H2,18,22)/t12-,14-/m1/s1
InChIKeyMPRYTOHLTNFVTL-TZMCWYRMSA-N
MW332.40 g/mol
LogP0.64
Rot. Bonds3

About (3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide

(3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide (PubChem CID 95585110) has the molecular formula C17H24N4O3 and a molecular weight of 332.40 g/mol. Its IUPAC name is (3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide
PubChem CID95585110
Molecular FormulaC17H24N4O3
Molecular Weight332.40 g/mol
Exact Mass332.18
IUPAC Name(3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide
SMILESC[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)c1ccc(N2CCOCC2)nc1
InChIInChI=1S/C17H24N4O3/c1-12-2-3-14(16(18)22)11-21(12)17(23)13-4-5-15(19-10-13)20-6-8-24-9-7-20/h4-5,10,12,14H,2-3,6-9,11H2,1H3,(H2,18,22)/t12-,14-/m1/s1
InChIKeyMPRYTOHLTNFVTL-TZMCWYRMSA-N
XLogP0.64
TPSA88.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide?
The IUPAC name of (3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide (CID 95585110) is (3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for (3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide is C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)c1ccc(N2CCOCC2)nc1.
What is the InChIKey of (3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide?
The InChIKey is MPRYTOHLTNFVTL-TZMCWYRMSA-N. The full InChI is InChI=1S/C17H24N4O3/c1-12-2-3-14(16(18)22)11-21(12)17(23)13-4-5-15(19-10-13)20-6-8-24-9-7-20/h4-5,10,12,14H,2-3,6-9,11H2,1H3,(H2,18,22)/t12-,14-/m1/s1.
What are the key properties of (3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide?
(3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide has a molecular weight of 332.40 g/mol, XLogP of 0.64, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,6R)-6-methyl-1-(6-morpholin-4-ylpyridine-3-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 95585110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).