2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide

C19H27N3O4 — CID 91906096

IUPAC2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide
SMILESCOCC(=O)N(C1CCOCC1)C1CCN(C(=O)c2ccncc2)CC1
InChIInChI=1S/C19H27N3O4/c1-25-14-18(23)22(17-6-12-26-13-7-17)16-4-10-21(11-5-16)19(24)15-2-8-20-9-3-15/h2-3,8-9,16-17H,4-7,10-14H2,1H3
InChIKeyRMKKVFYGTYUEKV-UHFFFAOYSA-N
MW361.44 g/mol
LogP1.34
Rot. Bonds5

About 2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide

2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide (PubChem CID 91906096) has the molecular formula C19H27N3O4 and a molecular weight of 361.44 g/mol. Its IUPAC name is 2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide
PubChem CID91906096
Molecular FormulaC19H27N3O4
Molecular Weight361.44 g/mol
Exact Mass361.20
IUPAC Name2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide
SMILESCOCC(=O)N(C1CCOCC1)C1CCN(C(=O)c2ccncc2)CC1
InChIInChI=1S/C19H27N3O4/c1-25-14-18(23)22(17-6-12-26-13-7-17)16-4-10-21(11-5-16)19(24)15-2-8-20-9-3-15/h2-3,8-9,16-17H,4-7,10-14H2,1H3
InChIKeyRMKKVFYGTYUEKV-UHFFFAOYSA-N
XLogP1.34
TPSA71.97 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.44
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide?
The IUPAC name of 2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide (CID 91906096) is 2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide is COCC(=O)N(C1CCOCC1)C1CCN(C(=O)c2ccncc2)CC1.
What is the InChIKey of 2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide?
The InChIKey is RMKKVFYGTYUEKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O4/c1-25-14-18(23)22(17-6-12-26-13-7-17)16-4-10-21(11-5-16)19(24)15-2-8-20-9-3-15/h2-3,8-9,16-17H,4-7,10-14H2,1H3.
What are the key properties of 2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide?
2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide has a molecular weight of 361.44 g/mol, XLogP of 1.34, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(oxan-4-yl)-N-[1-(pyridine-4-carbonyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 91906096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).