N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide

C20H30N4O2 — CID 139425024

IUPACN-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide
SMILESCCC1NC(c2ccc3c(c2)CC[C@H]3NC(=O)C2CCNCC2C)NO1
InChIInChI=1S/C20H30N4O2/c1-3-18-23-19(24-26-18)14-4-6-16-13(10-14)5-7-17(16)22-20(25)15-8-9-21-11-12(15)2/h4,6,10,12,15,17-19,21,23-24H,3,5,7-9,11H2,1-2H3,(H,22,25)/t12?,15?,17-,18?,19?/m1/s1
InChIKeyPWRZRVRFRFBXPP-NHEMNAMNSA-N
MW358.49 g/mol
LogP1.89
Rot. Bonds4

About N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide

N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide (PubChem CID 139425024) has the molecular formula C20H30N4O2 and a molecular weight of 358.49 g/mol. Its IUPAC name is N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide
PubChem CID139425024
Molecular FormulaC20H30N4O2
Molecular Weight358.49 g/mol
Exact Mass358.24
IUPAC NameN-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide
SMILESCCC1NC(c2ccc3c(c2)CC[C@H]3NC(=O)C2CCNCC2C)NO1
InChIInChI=1S/C20H30N4O2/c1-3-18-23-19(24-26-18)14-4-6-16-13(10-14)5-7-17(16)22-20(25)15-8-9-21-11-12(15)2/h4,6,10,12,15,17-19,21,23-24H,3,5,7-9,11H2,1-2H3,(H,22,25)/t12?,15?,17-,18?,19?/m1/s1
InChIKeyPWRZRVRFRFBXPP-NHEMNAMNSA-N
XLogP1.89
TPSA74.42 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 51.89
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-5-methyl-1,3,4-thiadiazolidine-2-carboxamide
CID 155296563
2-chloro-N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]piperidine-4-carboxamide
CID 139425087
N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-(trifluoromethyl)-1,3-oxazolidine-5-carboxamide
CID 139425090
N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-4-(1-hydroxyethyl)-1-azaspiro[5.8]tetradecane-2-carboxamide
CID 155296586
4-(hydroxymethyl)-N-[(1R)-5-[5-(methoxymethyl)-1,2,4-oxadiazolidin-3-yl]-2,3-dihydro-1H-inden-1-yl]piperidine-2-carboxamide
CID 139425116
2-[(3-methylpiperidine-4-carbonyl)amino]acetic acid
CID 130516226
N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)piperidine-3-carboxamide;hydrochloride
CID 119301428
N-[(1R)-5-(5-ethyl-2-nonyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methyl-1,2-diazaspiro[5.9]pentadecane-5-carboxamide
CID 155296643
N-(3-ethylcyclohexyl)-3-methylpiperidine-4-carboxamide
CID 114278691
(3R,4S)-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-4-(1-methylpyrazol-4-yl)pyrrolidine-3-carboxamide;hydrochloride
CID 120927276
1-ethyl-N-[(1R)-5-(5-ethyl-2-nonyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-6-oxopyridine-3-carboxamide
CID 155296577
(4S)-N-[(1S)-5-methyl-2,3-dihydro-1H-inden-1-yl]-2-oxoimidazolidine-4-carboxamide
CID 97071656

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide?
The IUPAC name of N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide (CID 139425024) is N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide?
The canonical SMILES for N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide is CCC1NC(c2ccc3c(c2)CC[C@H]3NC(=O)C2CCNCC2C)NO1.
What is the InChIKey of N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide?
The InChIKey is PWRZRVRFRFBXPP-NHEMNAMNSA-N. The full InChI is InChI=1S/C20H30N4O2/c1-3-18-23-19(24-26-18)14-4-6-16-13(10-14)5-7-17(16)22-20(25)15-8-9-21-11-12(15)2/h4,6,10,12,15,17-19,21,23-24H,3,5,7-9,11H2,1-2H3,(H,22,25)/t12?,15?,17-,18?,19?/m1/s1.
What are the key properties of N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide?
N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide has a molecular weight of 358.49 g/mol, XLogP of 1.89, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-5-(5-ethyl-1,2,4-oxadiazolidin-3-yl)-2,3-dihydro-1H-inden-1-yl]-3-methylpiperidine-4-carboxamide is sourced from PubChem (CID 139425024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).