3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide

C10H16N2O2 — CID 115154533

IUPAC3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide
SMILESCc1ccc(NC(=O)C(C)(C)CN)o1
InChIInChI=1S/C10H16N2O2/c1-7-4-5-8(14-7)12-9(13)10(2,3)6-11/h4-5H,6,11H2,1-3H3,(H,12,13)
InChIKeyJRFWARVEWKWUGN-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.51
Rot. Bonds3

About 3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide

3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide (PubChem CID 115154533) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide.

Molecular Properties

Compound Name3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide
PubChem CID115154533
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide
SMILESCc1ccc(NC(=O)C(C)(C)CN)o1
InChIInChI=1S/C10H16N2O2/c1-7-4-5-8(14-7)12-9(13)10(2,3)6-11/h4-5H,6,11H2,1-3H3,(H,12,13)
InChIKeyJRFWARVEWKWUGN-UHFFFAOYSA-N
XLogP1.51
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(5-methylfuran-2-yl)propanamide
CID 115152249
3-amino-N-(4-ethoxyphenyl)-2,2-dimethylpropanamide;hydrochloride
CID 119670707
3-amino-N-(5-bromo-2-methylphenyl)-2,2-dimethylpropanamide
CID 115426300
3-amino-N-(5-chloro-2-methylphenyl)-2,2-dimethylpropanamide;hydrochloride
CID 119676324
3-(aminomethyl)-N-(5-methylfuran-2-yl)oxetane-3-carboxamide
CID 115185551
3-amino-N-(3-hydroxy-4-methylphenyl)-2,2-dimethylpropanamide
CID 107701407
3-amino-2,2-dimethyl-N-(3-methylphenyl)propanamide;hydrochloride
CID 119670425
methyl N-[4-[(3-amino-2,2-dimethylpropanoyl)amino]phenyl]carbamate
CID 81490095
3-amino-2,2-dimethyl-N-(4-propan-2-ylsulfanylphenyl)propanamide
CID 115154519
3-amino-2,2-dimethyl-N-(6-methyl-2-pyridinyl)propanamide;dihydrochloride
CID 119827439
3-amino-N-(2-bromo-4-fluorophenyl)-2,2-dimethylpropanamide
CID 115426126
N-(1-amino-2,3-dimethylbutan-2-yl)-5-methylfuran-2-carboxamide
CID 81486834

Frequently Asked Questions

What is the IUPAC name of 3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide?
The IUPAC name of 3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide (CID 115154533) is 3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide.
What is the SMILES notation for 3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide?
The canonical SMILES for 3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide is Cc1ccc(NC(=O)C(C)(C)CN)o1.
What is the InChIKey of 3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide?
The InChIKey is JRFWARVEWKWUGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-7-4-5-8(14-7)12-9(13)10(2,3)6-11/h4-5H,6,11H2,1-3H3,(H,12,13).
What are the key properties of 3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide?
3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide has a molecular weight of 196.25 g/mol, XLogP of 1.51, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide is sourced from PubChem (CID 115154533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).