(3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide

C14H24N2O3 — CID 124737897

IUPAC(3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide
SMILESCCNC(=O)C1(NC(=O)[C@@H]2CCCOC2)CCCC1
InChIInChI=1S/C14H24N2O3/c1-2-15-13(18)14(7-3-4-8-14)16-12(17)11-6-5-9-19-10-11/h11H,2-10H2,1H3,(H,15,18)(H,16,17)/t11-/m1/s1
InChIKeyQJCQUDCETLODMA-LLVKDONJSA-N
MW268.36 g/mol
LogP0.98
Rot. Bonds4

About (3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide

(3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide (PubChem CID 124737897) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is (3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide
PubChem CID124737897
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name(3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide
SMILESCCNC(=O)C1(NC(=O)[C@@H]2CCCOC2)CCCC1
InChIInChI=1S/C14H24N2O3/c1-2-15-13(18)14(7-3-4-8-14)16-12(17)11-6-5-9-19-10-11/h11H,2-10H2,1H3,(H,15,18)(H,16,17)/t11-/m1/s1
InChIKeyQJCQUDCETLODMA-LLVKDONJSA-N
XLogP0.98
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(N'-hydroxycarbamimidoyl)cycloheptyl]oxane-3-carboxamide
CID 76982149
N-[[1-(hydroxymethyl)cyclopentyl]methyl]oxane-3-carboxamide
CID 113294474
N-[[1-(aminomethyl)cyclopentyl]methyl]oxane-3-carboxamide
CID 115365575
N-[1-(chloromethyl)-4-methylcyclohexyl]oxane-3-carboxamide
CID 113273232
2-methyl-2-(oxane-3-carbonylamino)pentanoic acid
CID 62759574
1-[(3-aminocyclohexanecarbonyl)amino]-N-propylcyclohexane-1-carboxamide
CID 119767184
N-(1-cyano-4-methylcyclohexyl)oxane-3-carboxamide
CID 55151061
N-[(4-tert-butyl-1-hydroxycyclohexyl)methyl]oxane-3-carboxamide
CID 111115377
1-[(3-aminocyclohexanecarbonyl)amino]-N-butylcyclohexane-1-carboxamide
CID 119767222
N-(3-amino-2-methylpropyl)oxane-3-carboxamide
CID 63011321
1-[(3-aminocyclohexanecarbonyl)amino]-N-butylcyclohexane-1-carboxamide;hydrochloride
CID 119767221
(3S)-N-[[1-(morpholin-4-ylmethyl)cyclohexyl]methyl]oxane-3-carboxamide
CID 96569943

Frequently Asked Questions

What is the IUPAC name of (3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide?
The IUPAC name of (3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide (CID 124737897) is (3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide.
What is the SMILES notation for (3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide?
The canonical SMILES for (3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide is CCNC(=O)C1(NC(=O)[C@@H]2CCCOC2)CCCC1.
What is the InChIKey of (3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide?
The InChIKey is QJCQUDCETLODMA-LLVKDONJSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-2-15-13(18)14(7-3-4-8-14)16-12(17)11-6-5-9-19-10-11/h11H,2-10H2,1H3,(H,15,18)(H,16,17)/t11-/m1/s1.
What are the key properties of (3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide?
(3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide has a molecular weight of 268.36 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[1-(ethylcarbamoyl)cyclopentyl]oxane-3-carboxamide is sourced from PubChem (CID 124737897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).