4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide

C16H26N4O3 — CID 136567627

IUPAC4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide
SMILESCOc1nn(C)cc1CNC(=O)C1COCCN1C1CCCC1
InChIInChI=1S/C16H26N4O3/c1-19-10-12(16(18-19)22-2)9-17-15(21)14-11-23-8-7-20(14)13-5-3-4-6-13/h10,13-14H,3-9,11H2,1-2H3,(H,17,21)
InChIKeyBRDOWFMOFKGYIW-UHFFFAOYSA-N
MW322.41 g/mol
LogP0.69
Rot. Bonds5

About 4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide

4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide (PubChem CID 136567627) has the molecular formula C16H26N4O3 and a molecular weight of 322.41 g/mol. Its IUPAC name is 4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide.

Molecular Properties

Compound Name4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide
PubChem CID136567627
Molecular FormulaC16H26N4O3
Molecular Weight322.41 g/mol
Exact Mass322.20
IUPAC Name4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide
SMILESCOc1nn(C)cc1CNC(=O)C1COCCN1C1CCCC1
InChIInChI=1S/C16H26N4O3/c1-19-10-12(16(18-19)22-2)9-17-15(21)14-11-23-8-7-20(14)13-5-3-4-6-13/h10,13-14H,3-9,11H2,1-2H3,(H,17,21)
InChIKeyBRDOWFMOFKGYIW-UHFFFAOYSA-N
XLogP0.69
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2-[2-(1-methylpyrazol-4-yl)piperidin-1-yl]-2-oxoacetamide
CID 167794133
N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-3,4-dihydro-1H-isochromene-1-carboxamide
CID 136567630
7-hydroxy-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]-2,3-dihydro-1H-indene-1-carboxamide
CID 136567619
(3S)-N-(1-tert-butylpyrazol-4-yl)-4-cyclopentylmorpholine-3-carboxamide
CID 129400309
(3S)-4-cyclopentyl-N-[(2S)-2-hydroxy-2-(5-methylfuran-2-yl)propyl]morpholine-3-carboxamide
CID 124621109
N-ethyl-4-piperidin-4-ylmorpholine-3-carboxamide
CID 83100378
(3S)-4-cyclopentyl-N-[(2S)-1-(1,3,5-trimethylpyrazol-4-yl)propan-2-yl]morpholine-3-carboxamide
CID 124621080
4-(4-aminocyclohexyl)-N-ethylmorpholine-3-carboxamide
CID 83103910
3-methoxy-1-methyl-N-[1-[(3R)-oxolan-3-yl]pyrazol-4-yl]pyrazole-4-carboxamide
CID 97428103
[3-(hydroxymethyl)morpholin-4-yl]-(3-methoxy-1-methylpyrazol-4-yl)methanone
CID 71785828
(3-methoxy-1-methylpyrazol-4-yl)-morpholin-4-ylmethanone
CID 16925251
4-cyclopentyl-N-[1-(2-phenylethyl)piperidin-4-yl]morpholine-3-carboxamide
CID 136537790

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide?
The IUPAC name of 4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide (CID 136567627) is 4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide.
What is the SMILES notation for 4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide?
The canonical SMILES for 4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide is COc1nn(C)cc1CNC(=O)C1COCCN1C1CCCC1.
What is the InChIKey of 4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide?
The InChIKey is BRDOWFMOFKGYIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O3/c1-19-10-12(16(18-19)22-2)9-17-15(21)14-11-23-8-7-20(14)13-5-3-4-6-13/h10,13-14H,3-9,11H2,1-2H3,(H,17,21).
What are the key properties of 4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide?
4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide has a molecular weight of 322.41 g/mol, XLogP of 0.69, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-N-[(3-methoxy-1-methylpyrazol-4-yl)methyl]morpholine-3-carboxamide is sourced from PubChem (CID 136567627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).