N-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide

C20H29N3O3 — CID 3238521

IUPACN-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide
SMILESCC1CCN(CCNC(=O)c2ccc(NC(=O)C3CCCO3)cc2)CC1
InChIInChI=1S/C20H29N3O3/c1-15-8-11-23(12-9-15)13-10-21-19(24)16-4-6-17(7-5-16)22-20(25)18-3-2-14-26-18/h4-7,15,18H,2-3,8-14H2,1H3,(H,21,24)(H,22,25)
InChIKeyLCGCTEVIXODMCQ-UHFFFAOYSA-N
MW359.47 g/mol
LogP2.27
Rot. Bonds6

About N-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide

N-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide (PubChem CID 3238521) has the molecular formula C20H29N3O3 and a molecular weight of 359.47 g/mol. Its IUPAC name is N-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide
PubChem CID3238521
Molecular FormulaC20H29N3O3
Molecular Weight359.47 g/mol
Exact Mass359.22
IUPAC NameN-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide
SMILESCC1CCN(CCNC(=O)c2ccc(NC(=O)C3CCCO3)cc2)CC1
InChIInChI=1S/C20H29N3O3/c1-15-8-11-23(12-9-15)13-10-21-19(24)16-4-6-17(7-5-16)22-20(25)18-3-2-14-26-18/h4-7,15,18H,2-3,8-14H2,1H3,(H,21,24)(H,22,25)
InChIKeyLCGCTEVIXODMCQ-UHFFFAOYSA-N
XLogP2.27
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-[2-(4-methylpiperidin-1-yl)ethyl]oxolane-2-carboxamide
CID 94119495
4-(cyclobutanecarbonylamino)-N-(2-morpholin-4-ylethyl)benzamide
CID 48581633
N-[4-(butan-2-ylcarbamoyl)phenyl]oxolane-2-carboxamide
CID 3242998
(2S,5R)-5-(aminomethyl)-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]oxolane-2-carboxamide
CID 120799120
N-[2-[[4-[(3,4-dimethylbenzoyl)amino]benzoyl]amino]ethyl]oxolane-2-carboxamide
CID 121062664
(2S,4S)-2-methyl-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 120645418
N-[3-[2-[4-(4-fluorophenyl)piperazin-1-yl]ethylcarbamoyl]phenyl]oxolane-2-carboxamide
CID 55657688
N-[2-(4-methylpiperidin-1-yl)ethyl]-1-(oxolane-2-carbonyl)piperidine-4-carboxamide
CID 56862595
N-[4-[(4-fluorophenyl)methylcarbamoyl]phenyl]oxolane-2-carboxamide
CID 4198331
3-[[4-[[2-(4-methylpiperidin-1-yl)acetyl]amino]benzoyl]amino]propanoic acid
CID 39182729
(2R)-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]oxolane-2-carboxamide
CID 42417081
(2S)-N-(4-tert-butylphenyl)oxolane-2-carboxamide
CID 8779725

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide?
The IUPAC name of N-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide (CID 3238521) is N-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide?
The canonical SMILES for N-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide is CC1CCN(CCNC(=O)c2ccc(NC(=O)C3CCCO3)cc2)CC1.
What is the InChIKey of N-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide?
The InChIKey is LCGCTEVIXODMCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O3/c1-15-8-11-23(12-9-15)13-10-21-19(24)16-4-6-17(7-5-16)22-20(25)18-3-2-14-26-18/h4-7,15,18H,2-3,8-14H2,1H3,(H,21,24)(H,22,25).
What are the key properties of N-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide?
N-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide has a molecular weight of 359.47 g/mol, XLogP of 2.27, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(4-methylpiperidin-1-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide is sourced from PubChem (CID 3238521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).