N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide

C10H18N4O — CID 115977436

IUPACN-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide
SMILESCNC(=O)CNC(C)CCn1cccn1
InChIInChI=1S/C10H18N4O/c1-9(12-8-10(15)11-2)4-7-14-6-3-5-13-14/h3,5-6,9,12H,4,7-8H2,1-2H3,(H,11,15)
InChIKeyMDEVHUMCYHBJKS-UHFFFAOYSA-N
MW210.28 g/mol
LogP-0.00
Rot. Bonds6

About N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide

N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide (PubChem CID 115977436) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide.

Molecular Properties

Compound NameN-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide
PubChem CID115977436
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC NameN-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide
SMILESCNC(=O)CNC(C)CCn1cccn1
InChIInChI=1S/C10H18N4O/c1-9(12-8-10(15)11-2)4-7-14-6-3-5-13-14/h3,5-6,9,12H,4,7-8H2,1-2H3,(H,11,15)
InChIKeyMDEVHUMCYHBJKS-UHFFFAOYSA-N
XLogP-0.00
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)propanamide
CID 103952287
(2R)-1-(4-pyrazol-1-ylbutan-2-ylamino)propan-2-ol
CID 103952260
N-(4-pyrazol-1-ylbutan-2-yl)pentan-1-amine
CID 115976552
N-(2-methylsulfonylethyl)-4-pyrazol-1-ylbutan-2-amine
CID 115977569
2,2-dimethyl-3-(4-pyrazol-1-ylbutan-2-ylamino)propan-1-ol
CID 115977842
N-(cyclobutylmethyl)-4-pyrazol-1-ylbutan-2-amine
CID 115977534
(2S)-2-(4-pyrazol-1-ylbutan-2-ylamino)propan-1-ol
CID 103952125
tert-butyl (3S,4R)-3-hydroxy-4-[[[(2R)-4-pyrazol-1-ylbutan-2-yl]amino]methyl]pyrrolidine-1-carboxylate
CID 124874421
N-carbamoyl-2-(1-pyrazol-1-ylpropan-2-ylamino)acetamide
CID 61462815
2,3-dimethyl-1-(4-pyrazol-1-ylbutan-2-ylamino)pentan-2-ol
CID 110012210
2-methyl-6-(3-pyrazol-1-ylpropanoylamino)heptanoic acid
CID 65285915
N-cyclopentyl-2-(1-pyrazol-1-ylpropan-2-ylamino)acetamide
CID 54951287

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide?
The IUPAC name of N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide (CID 115977436) is N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide.
What is the SMILES notation for N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide?
The canonical SMILES for N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide is CNC(=O)CNC(C)CCn1cccn1.
What is the InChIKey of N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide?
The InChIKey is MDEVHUMCYHBJKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-9(12-8-10(15)11-2)4-7-14-6-3-5-13-14/h3,5-6,9,12H,4,7-8H2,1-2H3,(H,11,15).
What are the key properties of N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide?
N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide has a molecular weight of 210.28 g/mol, XLogP of -0.00, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(4-pyrazol-1-ylbutan-2-ylamino)acetamide is sourced from PubChem (CID 115977436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).