2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide

C11H20N4O2 — CID 104618869

IUPAC2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide
SMILESCOCCCC(N)C(=O)Nc1n[nH]c(C)c1C
InChIInChI=1S/C11H20N4O2/c1-7-8(2)14-15-10(7)13-11(16)9(12)5-4-6-17-3/h9H,4-6,12H2,1-3H3,(H2,13,14,15,16)
InChIKeyURCNSEWUVVTQEQ-UHFFFAOYSA-N
MW240.31 g/mol
LogP0.72
Rot. Bonds6

About 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide

2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide (PubChem CID 104618869) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide.

Molecular Properties

Compound Name2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide
PubChem CID104618869
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide
SMILESCOCCCC(N)C(=O)Nc1n[nH]c(C)c1C
InChIInChI=1S/C11H20N4O2/c1-7-8(2)14-15-10(7)13-11(16)9(12)5-4-6-17-3/h9H,4-6,12H2,1-3H3,(H2,13,14,15,16)
InChIKeyURCNSEWUVVTQEQ-UHFFFAOYSA-N
XLogP0.72
TPSA93.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 50.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-3-methoxypropanamide
CID 104618673
(2S)-2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)hexanamide
CID 107146509
2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)butanamide
CID 104618696
3-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-2-methoxypropanamide
CID 106113701
2-amino-5-methoxy-N-pyrimidin-5-ylpentanamide
CID 107588458
5-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)hexanamide
CID 104618844
2-amino-5-methoxy-N-(5-methyl-2-pyridinyl)pentanamide
CID 81080952
2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide
CID 81081158
methyl N-[4-[(2-amino-5-methoxypentanoyl)amino]phenyl]carbamate
CID 81071019
2-amino-N-(2-hydroxyphenyl)-5-methoxypentanamide
CID 81089431
methyl 3-[(2-amino-5-methoxypentanoyl)amino]-2-methylbenzoate
CID 81084760
2-amino-N-(5-bromo-6-methyl-2-pyridinyl)-5-methoxypentanamide
CID 81102470

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide?
The IUPAC name of 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide (CID 104618869) is 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide.
What is the SMILES notation for 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide?
The canonical SMILES for 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide is COCCCC(N)C(=O)Nc1n[nH]c(C)c1C.
What is the InChIKey of 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide?
The InChIKey is URCNSEWUVVTQEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-7-8(2)14-15-10(7)13-11(16)9(12)5-4-6-17-3/h9H,4-6,12H2,1-3H3,(H2,13,14,15,16).
What are the key properties of 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide?
2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide has a molecular weight of 240.31 g/mol, XLogP of 0.72, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4,5-dimethyl-1H-pyrazol-3-yl)-5-methoxypentanamide is sourced from PubChem (CID 104618869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).