N-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide

C17H24N2O2 — CID 110362184

IUPACN-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide
SMILESCc1ccc(N2CCCCC2)cc1NC(=O)C1CCCO1
InChIInChI=1S/C17H24N2O2/c1-13-7-8-14(19-9-3-2-4-10-19)12-15(13)18-17(20)16-6-5-11-21-16/h7-8,12,16H,2-6,9-11H2,1H3,(H,18,20)
InChIKeyMKWXWSOXQUAWGW-UHFFFAOYSA-N
MW288.39 g/mol
LogP3.10
Rot. Bonds3

About N-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide

N-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide (PubChem CID 110362184) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide
PubChem CID110362184
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide
SMILESCc1ccc(N2CCCCC2)cc1NC(=O)C1CCCO1
InChIInChI=1S/C17H24N2O2/c1-13-7-8-14(19-9-3-2-4-10-19)12-15(13)18-17(20)16-6-5-11-21-16/h7-8,12,16H,2-6,9-11H2,1H3,(H,18,20)
InChIKeyMKWXWSOXQUAWGW-UHFFFAOYSA-N
XLogP3.10
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methoxy-5-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide
CID 110361978
N-[4-(azepan-1-yl)phenyl]oxolane-2-carboxamide
CID 51197534
(2R)-N-(5-bromo-2-methylphenyl)oxolane-2-carboxamide
CID 103849959
N-(3-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide
CID 47255294
N-[5-(3-hydroxyprop-1-ynyl)-2-methylphenyl]oxolane-2-carboxamide
CID 60802805
3-methyl-4-(oxolane-2-carbonylamino)benzoic acid
CID 16774236
N-(2-methyl-5-pyrrolidin-1-ylphenyl)-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide
CID 110361733
(2R)-N-(4-morpholin-4-ylphenyl)oxolane-2-carboxamide
CID 2476290
(2S)-N-[4-methyl-2-[[(2R)-oxolane-2-carbonyl]amino]phenyl]oxolane-2-carboxamide
CID 7926588
N-[2-[(2,5-dimethylphenyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 4916607
N-(4-chloro-2-methylphenyl)oxolane-2-carboxamide
CID 42906730
(2S)-N-[3-(4-methylpiperazin-1-yl)phenyl]oxolane-2-carboxamide
CID 141209517

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide?
The IUPAC name of N-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide (CID 110362184) is N-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide?
The canonical SMILES for N-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide is Cc1ccc(N2CCCCC2)cc1NC(=O)C1CCCO1.
What is the InChIKey of N-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide?
The InChIKey is MKWXWSOXQUAWGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-13-7-8-14(19-9-3-2-4-10-19)12-15(13)18-17(20)16-6-5-11-21-16/h7-8,12,16H,2-6,9-11H2,1H3,(H,18,20).
What are the key properties of N-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide?
N-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-5-piperidin-1-ylphenyl)oxolane-2-carboxamide is sourced from PubChem (CID 110362184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).