2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide

C12H15F3N2O2 — CID 79805488

IUPAC2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide
SMILESCC(N)(C(=O)N(Cc1ccco1)C1CC1)C(F)(F)F
InChIInChI=1S/C12H15F3N2O2/c1-11(16,12(13,14)15)10(18)17(8-4-5-8)7-9-3-2-6-19-9/h2-3,6,8H,4-5,7,16H2,1H3
InChIKeyANMYINIQEYSMQQ-UHFFFAOYSA-N
MW276.26 g/mol
LogP2.05
Rot. Bonds4

About 2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide

2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide (PubChem CID 79805488) has the molecular formula C12H15F3N2O2 and a molecular weight of 276.26 g/mol. Its IUPAC name is 2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide
PubChem CID79805488
Molecular FormulaC12H15F3N2O2
Molecular Weight276.26 g/mol
Exact Mass276.11
IUPAC Name2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide
SMILESCC(N)(C(=O)N(Cc1ccco1)C1CC1)C(F)(F)F
InChIInChI=1S/C12H15F3N2O2/c1-11(16,12(13,14)15)10(18)17(8-4-5-8)7-9-3-2-6-19-9/h2-3,6,8H,4-5,7,16H2,1H3
InChIKeyANMYINIQEYSMQQ-UHFFFAOYSA-N
XLogP2.05
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.26
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methyl-N-(2,2,2-trifluoroethyl)propanamide
CID 79793559
2-carbamothioyl-N-cyclopropyl-N-(furan-2-ylmethyl)-2-methylbutanamide
CID 114292137
N-(furan-2-ylmethyl)-2,2-dimethyl-N-(oxan-4-yl)propanamide
CID 121131278
N-cyclopentyl-N-(furan-2-ylmethyl)-2-methoxy-2-methylpropanamide
CID 103028787
3-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]-3-methylbutanoic acid
CID 64700693
N-cyclopropyl-N-(furan-2-ylmethyl)benzamide
CID 47022966
(2R)-2-[[cyclopropyl(furan-2-ylmethyl)carbamoyl]amino]-3,3-dimethylbutanoic acid
CID 103927859
N-cyclopropyl-N-(furan-2-ylmethyl)-3-sulfanylpropanamide
CID 107026655
N-cyclopentyl-2,2-difluoro-N-(furan-2-ylmethyl)acetamide
CID 103514769
4-[cyclopropyl(furan-2-ylmethyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63782822
N-cyclopropyl-N-(furan-2-ylmethyl)-4-hydroxybutanamide
CID 79200570
(2S)-2-amino-N-[2-[cyclopropyl(furan-2-ylmethyl)amino]-2-oxoethyl]-3-methylbutanamide
CID 82963604

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide?
The IUPAC name of 2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide (CID 79805488) is 2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide.
What is the SMILES notation for 2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide?
The canonical SMILES for 2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide is CC(N)(C(=O)N(Cc1ccco1)C1CC1)C(F)(F)F.
What is the InChIKey of 2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide?
The InChIKey is ANMYINIQEYSMQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N2O2/c1-11(16,12(13,14)15)10(18)17(8-4-5-8)7-9-3-2-6-19-9/h2-3,6,8H,4-5,7,16H2,1H3.
What are the key properties of 2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide?
2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide has a molecular weight of 276.26 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclopropyl-3,3,3-trifluoro-N-(furan-2-ylmethyl)-2-methylpropanamide is sourced from PubChem (CID 79805488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).