2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide

C14H19FN2O — CID 110480076

IUPAC2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide
SMILESCC(C)(N)C(=O)NCC1(c2ccccc2F)CC1
InChIInChI=1S/C14H19FN2O/c1-13(2,16)12(18)17-9-14(7-8-14)10-5-3-4-6-11(10)15/h3-6H,7-9,16H2,1-2H3,(H,17,18)
InChIKeyVCQCDHKWTZEIFO-UHFFFAOYSA-N
MW250.32 g/mol
LogP1.71
Rot. Bonds4

About 2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide

2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide (PubChem CID 110480076) has the molecular formula C14H19FN2O and a molecular weight of 250.32 g/mol. Its IUPAC name is 2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide
PubChem CID110480076
Molecular FormulaC14H19FN2O
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC Name2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide
SMILESCC(C)(N)C(=O)NCC1(c2ccccc2F)CC1
InChIInChI=1S/C14H19FN2O/c1-13(2,16)12(18)17-9-14(7-8-14)10-5-3-4-6-11(10)15/h3-6H,7-9,16H2,1-2H3,(H,17,18)
InChIKeyVCQCDHKWTZEIFO-UHFFFAOYSA-N
XLogP1.71
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[1-(2-fluorophenyl)cyclopropyl]methyl]-3-methoxyurea
CID 56806394
2-amino-2-methyl-N-[(1-phenylcyclopentyl)methyl]propanamide
CID 110480032
1-[[1-(2-fluorophenyl)cyclopropyl]methyl]-3-[[(3R)-3-hydroxythiolan-3-yl]methyl]urea
CID 97079912
4-[[1-(2-fluorophenyl)cyclopropyl]methylamino]-4-oxobutanoic acid
CID 110481809
N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide
CID 110481000
(2E,4E)-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]hexa-2,4-dienamide
CID 110481161
1-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2,3-dimethylguanidine
CID 86777752
N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide
CID 110481986
1-[[2-(dimethylamino)-1,3-thiazol-4-yl]methyl]-3-[[1-(2-fluorophenyl)cyclopropyl]methyl]urea
CID 71981655
2-amino-N-[[1-(2-bromophenyl)cyclopropyl]methyl]-2-phenylpropanamide;hydrochloride
CID 120593131
2-amino-N-[[1-(2-bromophenyl)cyclopropyl]methyl]-2-methylpentanamide
CID 119800186
N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-4-(hydroxymethyl)-4-methylpiperidine-1-carboxamide
CID 86792113

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide?
The IUPAC name of 2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide (CID 110480076) is 2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide.
What is the SMILES notation for 2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide?
The canonical SMILES for 2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide is CC(C)(N)C(=O)NCC1(c2ccccc2F)CC1.
What is the InChIKey of 2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide?
The InChIKey is VCQCDHKWTZEIFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O/c1-13(2,16)12(18)17-9-14(7-8-14)10-5-3-4-6-11(10)15/h3-6H,7-9,16H2,1-2H3,(H,17,18).
What are the key properties of 2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide?
2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide has a molecular weight of 250.32 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide is sourced from PubChem (CID 110480076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).