2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide

C11H20N4O2 — CID 114255909

IUPAC2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide
SMILESCCC(C)NCC(=O)Nc1cc(OC)n(C)n1
InChIInChI=1S/C11H20N4O2/c1-5-8(2)12-7-10(16)13-9-6-11(17-4)15(3)14-9/h6,8,12H,5,7H2,1-4H3,(H,13,14,16)
InChIKeyLACBANBYAKJGFL-UHFFFAOYSA-N
MW240.31 g/mol
LogP0.76
Rot. Bonds6

About 2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide

2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide (PubChem CID 114255909) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide
PubChem CID114255909
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide
SMILESCCC(C)NCC(=O)Nc1cc(OC)n(C)n1
InChIInChI=1S/C11H20N4O2/c1-5-8(2)12-7-10(16)13-9-6-11(17-4)15(3)14-9/h6,8,12H,5,7H2,1-4H3,(H,13,14,16)
InChIKeyLACBANBYAKJGFL-UHFFFAOYSA-N
XLogP0.76
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-amino-N-(5-methoxy-1-methylpyrazol-3-yl)-3-methylpentanamide
CID 114255933
2-chloro-N-(5-methoxy-1-methylpyrazol-3-yl)propanamide
CID 130497501
2-(4-methoxy-2-methylphenyl)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide
CID 138027048
(2S)-2-[(5-methoxy-1-methylpyrazol-3-yl)carbamoylamino]pentanoic acid
CID 114256177
2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide
CID 114932408
2-(butan-2-ylamino)-N-(3-methoxyphenyl)acetamide
CID 43179380
2-(butan-2-ylamino)-N-(2-methoxyphenyl)acetamide
CID 43179381
2-(butan-2-ylamino)-N-(1,2-oxazol-3-yl)acetamide
CID 42656286
2-(butan-2-ylamino)-N-pyridin-2-ylacetamide
CID 60852283
N-(2-methoxyethyl)-2-[(5-methoxy-1-methylpyrazol-3-yl)amino]propanamide
CID 114255815
4-amino-N-(5-methoxy-1-methylpyrazol-3-yl)benzamide
CID 114255282
2-[(5-methoxy-1-methylpyrazol-3-yl)methylamino]-N-propan-2-ylacetamide
CID 114255764

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide?
The IUPAC name of 2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide (CID 114255909) is 2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide is CCC(C)NCC(=O)Nc1cc(OC)n(C)n1.
What is the InChIKey of 2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide?
The InChIKey is LACBANBYAKJGFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-5-8(2)12-7-10(16)13-9-6-11(17-4)15(3)14-9/h6,8,12H,5,7H2,1-4H3,(H,13,14,16).
What are the key properties of 2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide?
2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide has a molecular weight of 240.31 g/mol, XLogP of 0.76, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-N-(5-methoxy-1-methylpyrazol-3-yl)acetamide is sourced from PubChem (CID 114255909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).