3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide

C10H18N4O — CID 61394138

IUPAC3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide
SMILESCC(C)(C)NCCC(=O)Nc1ccn[nH]1
InChIInChI=1S/C10H18N4O/c1-10(2,3)11-6-5-9(15)13-8-4-7-12-14-8/h4,7,11H,5-6H2,1-3H3,(H2,12,13,14,15)
InChIKeyIIYDZFTUXFPYFB-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.13
Rot. Bonds4

About 3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide

3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide (PubChem CID 61394138) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide.

Molecular Properties

Compound Name3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide
PubChem CID61394138
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide
SMILESCC(C)(C)NCCC(=O)Nc1ccn[nH]1
InChIInChI=1S/C10H18N4O/c1-10(2,3)11-6-5-9(15)13-8-4-7-12-14-8/h4,7,11H,5-6H2,1-3H3,(H2,12,13,14,15)
InChIKeyIIYDZFTUXFPYFB-UHFFFAOYSA-N
XLogP1.13
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-(ethylamino)-N-(1H-pyrazol-5-yl)propanamide
CID 62834246
3-acetamido-N-(1H-pyrazol-5-yl)propanamide
CID 61393399
3-chloro-N-(1H-pyrazol-5-yl)propanamide
CID 61394394
3-methylsulfinyl-N-(1H-pyrazol-5-yl)propanamide
CID 130652327
2-tert-butylsulfanyl-N-(1H-pyrazol-5-yl)acetamide
CID 61393876
2-methylsulfanyl-N-(1H-pyrazol-5-yl)acetamide
CID 61393731
2,2-dichloro-N-(1H-pyrazol-5-yl)propanamide
CID 126995468
3-(4-hydroxyphenyl)-N-(1H-pyrazol-5-yl)propanamide
CID 110483844
N-[3-oxo-3-(1H-pyrazol-5-ylamino)propyl]furan-2-carboxamide
CID 61393596
3-(tert-butylamino)-N-(1H-indazol-4-yl)propanamide
CID 54863202
3-(4-methylphenoxy)-N-(1H-pyrazol-5-yl)propanamide
CID 61393951
3-(4-methoxyphenoxy)-N-(1H-pyrazol-5-yl)propanamide
CID 61393499

Frequently Asked Questions

What is the IUPAC name of 3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide?
The IUPAC name of 3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide (CID 61394138) is 3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide.
What is the SMILES notation for 3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide?
The canonical SMILES for 3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide is CC(C)(C)NCCC(=O)Nc1ccn[nH]1.
What is the InChIKey of 3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide?
The InChIKey is IIYDZFTUXFPYFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-10(2,3)11-6-5-9(15)13-8-4-7-12-14-8/h4,7,11H,5-6H2,1-3H3,(H2,12,13,14,15).
What are the key properties of 3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide?
3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide has a molecular weight of 210.28 g/mol, XLogP of 1.13, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(tert-butylamino)-N-(1H-pyrazol-5-yl)propanamide is sourced from PubChem (CID 61394138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).