2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide

C14H19FN2O — CID 110479728

IUPAC2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide
SMILESCN(C)CC(=O)NCC1(c2ccc(F)cc2)CC1
InChIInChI=1S/C14H19FN2O/c1-17(2)9-13(18)16-10-14(7-8-14)11-3-5-12(15)6-4-11/h3-6H,7-10H2,1-2H3,(H,16,18)
InChIKeyJQIQBCFQYBPJNW-UHFFFAOYSA-N
MW250.32 g/mol
LogP1.54
Rot. Bonds5

About 2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide

2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide (PubChem CID 110479728) has the molecular formula C14H19FN2O and a molecular weight of 250.32 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide
PubChem CID110479728
Molecular FormulaC14H19FN2O
Molecular Weight250.32 g/mol
Exact Mass250.15
IUPAC Name2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide
SMILESCN(C)CC(=O)NCC1(c2ccc(F)cc2)CC1
InChIInChI=1S/C14H19FN2O/c1-17(2)9-13(18)16-10-14(7-8-14)11-3-5-12(15)6-4-11/h3-6H,7-10H2,1-2H3,(H,16,18)
InChIKeyJQIQBCFQYBPJNW-UHFFFAOYSA-N
XLogP1.54
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-N-[[1-(4-fluorophenyl)cyclopentyl]methyl]acetamide
CID 87014302
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-(methylamino)acetamide;hydrochloride
CID 119731211
3-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]propanamide
CID 110478929
3-chloro-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]propanamide
CID 110480778
3-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]butanamide
CID 119731231
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide
CID 42266064
2-(dimethylamino)-N-[(1-pyridin-3-ylcyclopropyl)methyl]acetamide
CID 110479717
(E)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]but-2-enamide
CID 110477965
(2R)-2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]propanamide
CID 119293598
2-[(4-fluorophenyl)sulfonyl-methylamino]-N-[(1-phenylcyclobutyl)methyl]acetamide
CID 46700398
3-[[1-(4-fluorophenyl)cyclopropyl]methyl]-1-(2-hydroxyethyl)-1-propylurea
CID 110896534
1-[2-(dimethylamino)-1-phenylethyl]-3-[[1-(4-fluorophenyl)cyclopropyl]methyl]urea
CID 78886107

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide?
The IUPAC name of 2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide (CID 110479728) is 2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide?
The canonical SMILES for 2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide is CN(C)CC(=O)NCC1(c2ccc(F)cc2)CC1.
What is the InChIKey of 2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide?
The InChIKey is JQIQBCFQYBPJNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O/c1-17(2)9-13(18)16-10-14(7-8-14)11-3-5-12(15)6-4-11/h3-6H,7-10H2,1-2H3,(H,16,18).
What are the key properties of 2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide?
2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide has a molecular weight of 250.32 g/mol, XLogP of 1.54, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]acetamide is sourced from PubChem (CID 110479728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).