N-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide

C14H20FN3O — CID 107423548

IUPACN-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide
SMILESCc1ccc(F)cc1NC(=O)CNC1(C)CCNC1
InChIInChI=1S/C14H20FN3O/c1-10-3-4-11(15)7-12(10)18-13(19)8-17-14(2)5-6-16-9-14/h3-4,7,16-17H,5-6,8-9H2,1-2H3,(H,18,19)
InChIKeyLDCMZCIJPWZPTB-UHFFFAOYSA-N
MW265.33 g/mol
LogP1.41
Rot. Bonds4

About N-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide

N-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide (PubChem CID 107423548) has the molecular formula C14H20FN3O and a molecular weight of 265.33 g/mol. Its IUPAC name is N-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide.

Molecular Properties

Compound NameN-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide
PubChem CID107423548
Molecular FormulaC14H20FN3O
Molecular Weight265.33 g/mol
Exact Mass265.16
IUPAC NameN-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide
SMILESCc1ccc(F)cc1NC(=O)CNC1(C)CCNC1
InChIInChI=1S/C14H20FN3O/c1-10-3-4-11(15)7-12(10)18-13(19)8-17-14(2)5-6-16-9-14/h3-4,7,16-17H,5-6,8-9H2,1-2H3,(H,18,19)
InChIKeyLDCMZCIJPWZPTB-UHFFFAOYSA-N
XLogP1.41
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 51.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-dichlorophenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide
CID 107423637
N-(4-bromo-2-chlorophenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide
CID 107424546
N-[(4-fluoro-2-methylphenyl)methyl]-3-methylpyrrolidin-3-amine
CID 107424604
N-(5-methyl-1,2-oxazol-3-yl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide
CID 107423504
methyl 3-[[2-[(3-methylpyrrolidin-3-yl)amino]acetyl]amino]thiophene-2-carboxylate
CID 107423542
2-(1-aminocyclopentyl)-N-(5-fluoro-2-methylphenyl)acetamide
CID 64683745
N-(8λ4-thia-7,9-diazabicyclo[4.3.0]nona-1(6),2,4,7,8-pentaen-2-yl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide
CID 107424306
2-amino-N-(5-fluoro-2-methylphenyl)acetamide
CID 24700155
1-(aminomethyl)-N-(5-fluoro-2-methylphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119674013
N-[2-(5-fluoro-2-methylanilino)-2-oxoethyl]benzamide
CID 9211846
N-(5-fluoro-2-methylphenyl)-2-morpholin-2-ylacetamide
CID 66432981
N-(5-fluoro-2-methylphenyl)-4-(4-fluorophenyl)-4-oxobutanamide
CID 9211912

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide?
The IUPAC name of N-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide (CID 107423548) is N-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide.
What is the SMILES notation for N-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide?
The canonical SMILES for N-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide is Cc1ccc(F)cc1NC(=O)CNC1(C)CCNC1.
What is the InChIKey of N-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide?
The InChIKey is LDCMZCIJPWZPTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3O/c1-10-3-4-11(15)7-12(10)18-13(19)8-17-14(2)5-6-16-9-14/h3-4,7,16-17H,5-6,8-9H2,1-2H3,(H,18,19).
What are the key properties of N-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide?
N-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide has a molecular weight of 265.33 g/mol, XLogP of 1.41, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-methylphenyl)-2-[(3-methylpyrrolidin-3-yl)amino]acetamide is sourced from PubChem (CID 107423548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).