N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide

C19H21FN2O — CID 95307336

IUPACN-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide
SMILESCN(C(=O)C1CCCC1)[C@@H](c1cccc(F)c1)c1ccccn1
InChIInChI=1S/C19H21FN2O/c1-22(19(23)14-7-2-3-8-14)18(17-11-4-5-12-21-17)15-9-6-10-16(20)13-15/h4-6,9-14,18H,2-3,7-8H2,1H3/t18-/m0/s1
InChIKeyGYQCSQFOZVCMMP-SFHVURJKSA-N
MW312.39 g/mol
LogP3.96
Rot. Bonds4

About N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide

N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide (PubChem CID 95307336) has the molecular formula C19H21FN2O and a molecular weight of 312.39 g/mol. Its IUPAC name is N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide.

Molecular Properties

Compound NameN-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide
PubChem CID95307336
Molecular FormulaC19H21FN2O
Molecular Weight312.39 g/mol
Exact Mass312.16
IUPAC NameN-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide
SMILESCN(C(=O)C1CCCC1)[C@@H](c1cccc(F)c1)c1ccccn1
InChIInChI=1S/C19H21FN2O/c1-22(19(23)14-7-2-3-8-14)18(17-11-4-5-12-21-17)15-9-6-10-16(20)13-15/h4-6,9-14,18H,2-3,7-8H2,1H3/t18-/m0/s1
InChIKeyGYQCSQFOZVCMMP-SFHVURJKSA-N
XLogP3.96
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.39
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-1-methyl-3-phenylurea
CID 95150596
2-(cyclopropylmethoxy)-N-[(R)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylacetamide
CID 95282605
N-[(R)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylpyrazine-2-carboxamide
CID 95330210
1-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-1-methyl-3-prop-2-enylurea
CID 95330331
4-(4-fluorophenyl)-N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methyl-4-oxobutanamide
CID 52524823
1-(2,2-dimethylpropanoyl)-N-[(4-fluorophenyl)-pyridin-2-ylmethyl]-N-methylpiperidine-4-carboxamide
CID 126473148
N-[cyano(pyridin-2-yl)methyl]-N-methylcyclohexanecarboxamide
CID 82120784
N-[(4-fluorophenyl)-pyridin-2-ylmethyl]-1-(furan-2-carbonyl)-N-methylpiperidine-4-carboxamide
CID 126471519
N-[(3-chlorophenyl)-pyridin-2-ylmethyl]-1-(2,5-dibromophenyl)sulfonyl-N-methylpiperidine-4-carboxamide
CID 166346234
N-butyl-2-[[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-methylamino]acetamide
CID 95145307
N-[(3-fluorophenyl)-pyridin-2-ylmethyl]-2-hydroxycyclopentane-1-carboxamide
CID 110016699
1-[[(3-fluorophenyl)-pyridin-2-ylmethyl]carbamoyl]piperidine-3-carboxylic acid
CID 122008448

Frequently Asked Questions

What is the IUPAC name of N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide?
The IUPAC name of N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide (CID 95307336) is N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide.
What is the SMILES notation for N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide?
The canonical SMILES for N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide is CN(C(=O)C1CCCC1)[C@@H](c1cccc(F)c1)c1ccccn1.
What is the InChIKey of N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide?
The InChIKey is GYQCSQFOZVCMMP-SFHVURJKSA-N. The full InChI is InChI=1S/C19H21FN2O/c1-22(19(23)14-7-2-3-8-14)18(17-11-4-5-12-21-17)15-9-6-10-16(20)13-15/h4-6,9-14,18H,2-3,7-8H2,1H3/t18-/m0/s1.
What are the key properties of N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide?
N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide has a molecular weight of 312.39 g/mol, XLogP of 3.96, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(S)-(3-fluorophenyl)-pyridin-2-ylmethyl]-N-methylcyclopentanecarboxamide is sourced from PubChem (CID 95307336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).