3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide

C10H18N4O — CID 65264992

IUPAC3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide
SMILESCC(C)(N)C(C)(C)C(=O)Nc1cn[nH]c1
InChIInChI=1S/C10H18N4O/c1-9(2,10(3,4)11)8(15)14-7-5-12-13-6-7/h5-6H,11H2,1-4H3,(H,12,13)(H,14,15)
InChIKeyMTPZEGRCHISGRT-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.11
Rot. Bonds3

About 3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide

3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide (PubChem CID 65264992) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide.

Molecular Properties

Compound Name3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide
PubChem CID65264992
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide
SMILESCC(C)(N)C(C)(C)C(=O)Nc1cn[nH]c1
InChIInChI=1S/C10H18N4O/c1-9(2,10(3,4)11)8(15)14-7-5-12-13-6-7/h5-6H,11H2,1-4H3,(H,12,13)(H,14,15)
InChIKeyMTPZEGRCHISGRT-UHFFFAOYSA-N
XLogP1.11
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-2,2-dimethyl-N-(1H-pyrazol-4-yl)propanamide
CID 63680356
3-amino-2,2-difluoro-N-(1H-pyrazol-4-yl)propanamide
CID 130600837
1H-pyrazol-4-ylcarbamic acid
CID 66846919
1H-pyrazol-4-ylcarbamic acid
CID 66846920
3-amino-2,2,3-trimethyl-N-(1-methylpyrazol-4-yl)butanamide
CID 65264942
2-amino-3-methyl-N-(1H-pyrazol-4-yl)butanamide
CID 43540260
2-amino-N-(1H-pyrazol-4-yl)propanamide
CID 43540259
3-amino-N-(4-hydroxyphenyl)-2,2,3-trimethylbutanamide
CID 65264564
2-oxo-2-(1H-pyrazol-4-ylamino)acetic acid
CID 43540349
3-oxo-N-(1H-pyrazol-4-yl)butanamide
CID 43540271
2-hydroxy-N-(1H-pyrazol-4-yl)acetamide
CID 83815139
N-(4-acetylphenyl)-3-amino-2,2,3-trimethylbutanamide
CID 65269737

Frequently Asked Questions

What is the IUPAC name of 3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide?
The IUPAC name of 3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide (CID 65264992) is 3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide.
What is the SMILES notation for 3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide?
The canonical SMILES for 3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide is CC(C)(N)C(C)(C)C(=O)Nc1cn[nH]c1.
What is the InChIKey of 3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide?
The InChIKey is MTPZEGRCHISGRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-9(2,10(3,4)11)8(15)14-7-5-12-13-6-7/h5-6H,11H2,1-4H3,(H,12,13)(H,14,15).
What are the key properties of 3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide?
3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide has a molecular weight of 210.28 g/mol, XLogP of 1.11, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2,2,3-trimethyl-N-(1H-pyrazol-4-yl)butanamide is sourced from PubChem (CID 65264992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).