N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide

C16H28N4O2 — CID 126840374

IUPACN-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide
SMILESCc1c(CNC(=O)CCC(C)(C)N2CCOCC2)cnn1C
InChIInChI=1S/C16H28N4O2/c1-13-14(12-18-19(13)4)11-17-15(21)5-6-16(2,3)20-7-9-22-10-8-20/h12H,5-11H2,1-4H3,(H,17,21)
InChIKeyHGEVUOGIBMCDSU-UHFFFAOYSA-N
MW308.43 g/mol
LogP1.24
Rot. Bonds6

About N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide

N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide (PubChem CID 126840374) has the molecular formula C16H28N4O2 and a molecular weight of 308.43 g/mol. Its IUPAC name is N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide.

Molecular Properties

Compound NameN-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide
PubChem CID126840374
Molecular FormulaC16H28N4O2
Molecular Weight308.43 g/mol
Exact Mass308.22
IUPAC NameN-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide
SMILESCc1c(CNC(=O)CCC(C)(C)N2CCOCC2)cnn1C
InChIInChI=1S/C16H28N4O2/c1-13-14(12-18-19(13)4)11-17-15(21)5-6-16(2,3)20-7-9-22-10-8-20/h12H,5-11H2,1-4H3,(H,17,21)
InChIKeyHGEVUOGIBMCDSU-UHFFFAOYSA-N
XLogP1.24
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(cyclohexylmethyl)-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-6-oxo-3-piperidinecarboxamide
CID 24817829
1'-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]-4-(morpholin-4-ylcarbonyl)-1,4'-bipiperidine
CID 16190633
1'-[(5-methyl-1-propyl-1H-pyrazol-4-yl)methyl]-4-(morpholin-4-ylcarbonyl)-1,4'-bipiperidine
CID 16190708
[1-[(1,5-Dimethylpyrazol-4-yl)methyl]-2-methylpyrrolidin-2-yl]-morpholin-4-ylmethanone
CID 110249131
N-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-2-(1-isopropyl-3-oxopiperazin-2-yl)-N-methylacetamide
CID 50968875
N-({(3S,4R)-3-(dimethylamino)-1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]hexahydro-4-pyridinyl}methyl)-2-methoxyacetamide
CID 91920969
N-{[(3S4R)-3-(Dimethylamino)-1-[(1-ethyl-3-methyl-1H-pyrazol-4-YL)methyl]piperidin-4-YL]methyl}-2-methoxyacetamide
CID 91920970
1,3-dimethyl-N-[(1S)-1-(1-morpholin-4-ylcyclopentyl)ethyl]pyrazole-4-carboxamide
CID 97787066
(2S)-4-[(5-methyl-1-propylpyrazol-4-yl)methyl]morpholine-2-carboxamide
CID 97935666
(3S)-N-(cyclopropylmethyl)-1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-3-fluoropiperidine-3-carboxamide
CID 164635298
(4S)-N-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]-4-morpholin-4-ylpentanamide
CID 164636064
[(2R)-1-[(3-methyl-1-propan-2-ylpyrazol-4-yl)methyl]piperidin-2-yl]methyl N-propylcarbamate
CID 164639601

Frequently Asked Questions

What is the IUPAC name of N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide?
The IUPAC name of N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide (CID 126840374) is N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide.
What is the SMILES notation for N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide?
The canonical SMILES for N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide is Cc1c(CNC(=O)CCC(C)(C)N2CCOCC2)cnn1C.
What is the InChIKey of N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide?
The InChIKey is HGEVUOGIBMCDSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O2/c1-13-14(12-18-19(13)4)11-17-15(21)5-6-16(2,3)20-7-9-22-10-8-20/h12H,5-11H2,1-4H3,(H,17,21).
What are the key properties of N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide?
N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide has a molecular weight of 308.43 g/mol, XLogP of 1.24, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,5-dimethylpyrazol-4-yl)methyl]-4-methyl-4-morpholin-4-ylpentanamide is sourced from PubChem (CID 126840374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).