(2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone

C17H24N2O2 — CID 171362080

IUPAC(2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone
SMILESCc1c(C(=O)N2CCOCC2)cccc1C1CCNCC1
InChIInChI=1S/C17H24N2O2/c1-13-15(14-5-7-18-8-6-14)3-2-4-16(13)17(20)19-9-11-21-12-10-19/h2-4,14,18H,5-12H2,1H3
InChIKeyOMXXBVJNUMIGIM-UHFFFAOYSA-N
MW288.39 g/mol
LogP1.93
Rot. Bonds2

About (2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone

(2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone (PubChem CID 171362080) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is (2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone
PubChem CID171362080
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name(2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone
SMILESCc1c(C(=O)N2CCOCC2)cccc1C1CCNCC1
InChIInChI=1S/C17H24N2O2/c1-13-15(14-5-7-18-8-6-14)3-2-4-16(13)17(20)19-9-11-21-12-10-19/h2-4,14,18H,5-12H2,1H3
InChIKeyOMXXBVJNUMIGIM-UHFFFAOYSA-N
XLogP1.93
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-fluoro-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone
CID 166001125
(2-methylmorpholin-4-yl)-(2-methyl-3-piperidin-4-ylphenyl)methanone;hydrochloride
CID 171362081
N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119304348
morpholin-4-yl-(5-piperidin-4-ylnaphthalen-2-yl)methanone
CID 171396936
N,N,2-trimethyl-3-piperidin-4-ylbenzamide;hydrochloride
CID 171362069
[1-(2,3-dimethylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 38490689
(2-fluoro-5-piperidin-4-ylphenyl)-morpholin-4-ylmethanone
CID 171361963
N-ethyl-2-methyl-3-piperidin-4-ylbenzamide;hydrochloride
CID 171362043
(2-fluoro-3-piperidin-4-ylphenyl)-(3-methylpiperidin-1-yl)methanone;hydrochloride
CID 166001112
N-(cyclopropylmethyl)-2-methyl-3-piperidin-4-ylbenzamide
CID 171362054
2-cyclopropyl-N-[2-methyl-3-(morpholine-4-carbonyl)phenyl]propanamide
CID 126786282
morpholin-4-yl-[4-(4-propan-2-ylphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-6-yl]methanone
CID 17239095

Frequently Asked Questions

What is the IUPAC name of (2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone?
The IUPAC name of (2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone (CID 171362080) is (2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone.
What is the SMILES notation for (2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone?
The canonical SMILES for (2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone is Cc1c(C(=O)N2CCOCC2)cccc1C1CCNCC1.
What is the InChIKey of (2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone?
The InChIKey is OMXXBVJNUMIGIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-13-15(14-5-7-18-8-6-14)3-2-4-16(13)17(20)19-9-11-21-12-10-19/h2-4,14,18H,5-12H2,1H3.
What are the key properties of (2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone?
(2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone has a molecular weight of 288.39 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-3-piperidin-4-ylphenyl)-morpholin-4-ylmethanone is sourced from PubChem (CID 171362080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).