N-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide

C10H18N4O — CID 79779691

IUPACN-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide
SMILESCCC(C)NC(=O)CNc1ccn(C)n1
InChIInChI=1S/C10H18N4O/c1-4-8(2)12-10(15)7-11-9-5-6-14(3)13-9/h5-6,8H,4,7H2,1-3H3,(H,11,13)(H,12,15)
InChIKeySSUGSQJWIIHZNF-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.75
Rot. Bonds5

About N-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide

N-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide (PubChem CID 79779691) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is N-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide
PubChem CID79779691
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC NameN-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide
SMILESCCC(C)NC(=O)CNc1ccn(C)n1
InChIInChI=1S/C10H18N4O/c1-4-8(2)12-10(15)7-11-9-5-6-14(3)13-9/h5-6,8H,4,7H2,1-3H3,(H,11,13)(H,12,15)
InChIKeySSUGSQJWIIHZNF-UHFFFAOYSA-N
XLogP0.75
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(1-methylpyrazol-3-yl)amino]-N-pentan-2-ylacetamide
CID 79778666
N-butyl-2-[(1-methylpyrazol-3-yl)amino]acetamide
CID 79779696
N-[(2R)-butan-2-yl]-1-methylpyrazole-3-carboxamide
CID 35763827
N-[(2S)-butan-2-yl]-1-methylpyrazole-3-carboxamide
CID 35763828
4-[2-(butan-2-ylamino)-2-oxoethyl]-N-(1-methylpyrazol-3-yl)piperazine-1-carboxamide
CID 60616938
ethyl 2-[(1-methylpyrazol-3-yl)amino]acetate
CID 79778560
N-(4-chlorophenyl)-2-[(1-methylpyrazol-3-yl)amino]acetamide
CID 79779586
(2R)-1-[(1-methylpyrazol-3-yl)amino]propan-2-ol
CID 106932300
ethyl 2-[[(1-methylpyrazol-3-yl)amino]methyl]prop-2-enoate
CID 103256828
N-[(2S)-butan-2-yl]-2-pyridin-4-ylsulfanylacetamide
CID 94102095
1-(butan-2-ylamino)-3-(1-methylpyrazol-3-yl)propan-2-one
CID 116556161
3,3-difluoro-N-(1-methylpyrazol-3-yl)propanamide
CID 177229835

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide?
The IUPAC name of N-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide (CID 79779691) is N-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide.
What is the SMILES notation for N-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide?
The canonical SMILES for N-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide is CCC(C)NC(=O)CNc1ccn(C)n1.
What is the InChIKey of N-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide?
The InChIKey is SSUGSQJWIIHZNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-4-8(2)12-10(15)7-11-9-5-6-14(3)13-9/h5-6,8H,4,7H2,1-3H3,(H,11,13)(H,12,15).
What are the key properties of N-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide?
N-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide has a molecular weight of 210.28 g/mol, XLogP of 0.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[(1-methylpyrazol-3-yl)amino]acetamide is sourced from PubChem (CID 79779691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).