2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide

C14H25N5O2 — CID 107109733

IUPAC2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)C(C)N1CCC(n2ccc(N)n2)CC1
InChIInChI=1S/C14H25N5O2/c1-11(14(20)16-6-10-21-2)18-7-3-12(4-8-18)19-9-5-13(15)17-19/h5,9,11-12H,3-4,6-8,10H2,1-2H3,(H2,15,17)(H,16,20)
InChIKeyWKGJKCPCUOKZFL-UHFFFAOYSA-N
MW295.39 g/mol
LogP0.25
Rot. Bonds6

About 2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide

2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide (PubChem CID 107109733) has the molecular formula C14H25N5O2 and a molecular weight of 295.39 g/mol. Its IUPAC name is 2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide
PubChem CID107109733
Molecular FormulaC14H25N5O2
Molecular Weight295.39 g/mol
Exact Mass295.20
IUPAC Name2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)C(C)N1CCC(n2ccc(N)n2)CC1
InChIInChI=1S/C14H25N5O2/c1-11(14(20)16-6-10-21-2)18-7-3-12(4-8-18)19-9-5-13(15)17-19/h5,9,11-12H,3-4,6-8,10H2,1-2H3,(H2,15,17)(H,16,20)
InChIKeyWKGJKCPCUOKZFL-UHFFFAOYSA-N
XLogP0.25
TPSA85.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[(3R)-3-aminopyrrolidin-1-yl]-N-(2-methoxyethyl)propanamide
CID 115302045
2-(3-aminopyrazol-1-yl)-N-(3-methoxypropyl)propanamide
CID 60783044
2-[1-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]piperidin-4-yl]oxyacetic acid
CID 63902809
1-[1-(2-methoxyethylamino)-1-oxopropan-2-yl]pyrrolidine-3-carboxylic acid
CID 55150446
(2S)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methoxyethyl)propanamide
CID 9248289
2-[4-(4-chlorophenyl)piperazin-1-yl]-N-(2-methoxyethyl)propanamide
CID 83284147
(2R)-2-(4-benzylpiperazin-1-yl)-N-(2-methoxyethyl)propanamide
CID 9275184
1-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-2-cyclopropylethanone
CID 107108865
2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(3-methoxypropyl)propanamide
CID 63847171
2-[4-[hydroxy(phenyl)methyl]piperidin-1-yl]-N-(3-methoxypropyl)propanamide
CID 110898270
2-(8-amino-3,4-dihydro-1H-isoquinolin-2-yl)-N-(2-methoxyethyl)propanamide
CID 114524084
1-[1-(4-methylpentyl)piperidin-4-yl]pyrazol-3-amine
CID 107109773

Frequently Asked Questions

What is the IUPAC name of 2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide?
The IUPAC name of 2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide (CID 107109733) is 2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide is COCCNC(=O)C(C)N1CCC(n2ccc(N)n2)CC1.
What is the InChIKey of 2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide?
The InChIKey is WKGJKCPCUOKZFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O2/c1-11(14(20)16-6-10-21-2)18-7-3-12(4-8-18)19-9-5-13(15)17-19/h5,9,11-12H,3-4,6-8,10H2,1-2H3,(H2,15,17)(H,16,20).
What are the key properties of 2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide?
2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide has a molecular weight of 295.39 g/mol, XLogP of 0.25, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3-aminopyrazol-1-yl)piperidin-1-yl]-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 107109733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).