N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide

C16H15FN2O — CID 110481986

IUPACN-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide
SMILESO=C(NCC1(c2ccccc2F)CC1)c1ccccn1
InChIInChI=1S/C16H15FN2O/c17-13-6-2-1-5-12(13)16(8-9-16)11-19-15(20)14-7-3-4-10-18-14/h1-7,10H,8-9,11H2,(H,19,20)
InChIKeyGHTIYYMFGOMLFJ-UHFFFAOYSA-N
MW270.31 g/mol
LogP2.68
Rot. Bonds4

About N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide

N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide (PubChem CID 110481986) has the molecular formula C16H15FN2O and a molecular weight of 270.31 g/mol. Its IUPAC name is N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide
PubChem CID110481986
Molecular FormulaC16H15FN2O
Molecular Weight270.31 g/mol
Exact Mass270.12
IUPAC NameN-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide
SMILESO=C(NCC1(c2ccccc2F)CC1)c1ccccn1
InChIInChI=1S/C16H15FN2O/c17-13-6-2-1-5-12(13)16(8-9-16)11-19-15(20)14-7-3-4-10-18-14/h1-7,10H,8-9,11H2,(H,19,20)
InChIKeyGHTIYYMFGOMLFJ-UHFFFAOYSA-N
XLogP2.68
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.31
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(2-methoxyphenyl)cyclopropyl]methyl]pyridine-2-carboxamide
CID 110444314
N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-1H-pyrrole-2-carboxamide
CID 110481000
1-[[1-(2-fluorophenyl)cyclopropyl]methyl]-3-methoxyurea
CID 56806394
5-[[1-(2-chlorophenyl)cyclopropyl]methylcarbamoyl]pyrazine-2-carboxylic acid
CID 120690298
4-[[1-(2-fluorophenyl)cyclopropyl]methylamino]-4-oxobutanoic acid
CID 110481809
N-[[1-(dimethylamino)cyclopentyl]methyl]pyridine-2-carboxamide
CID 47108596
2-amino-N-[[1-(2-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide
CID 110480076
N-[[1-(2-bromoethyl)cyclopropyl]methyl]pyridine-2-carboxamide
CID 114758379
N-[1-[2-[[1-(2-chlorophenyl)cyclopropyl]methylamino]-2-oxoethyl]pyrazol-4-yl]pyridine-2-carboxamide
CID 92634675
N-[[1-(dimethylamino)cyclohexyl]methyl]pyridine-2-carboxamide
CID 4787654
1-[[2-(dimethylamino)-1,3-thiazol-4-yl]methyl]-3-[[1-(2-fluorophenyl)cyclopropyl]methyl]urea
CID 71981655
N-[[4-(2-fluorophenyl)oxan-4-yl]methyl]-2-methyl-6-oxo-1H-pyrimidine-4-carboxamide
CID 135963071

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide?
The IUPAC name of N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide (CID 110481986) is N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide?
The canonical SMILES for N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide is O=C(NCC1(c2ccccc2F)CC1)c1ccccn1.
What is the InChIKey of N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide?
The InChIKey is GHTIYYMFGOMLFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O/c17-13-6-2-1-5-12(13)16(8-9-16)11-19-15(20)14-7-3-4-10-18-14/h1-7,10H,8-9,11H2,(H,19,20).
What are the key properties of N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide?
N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide has a molecular weight of 270.31 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-fluorophenyl)cyclopropyl]methyl]pyridine-2-carboxamide is sourced from PubChem (CID 110481986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).