N-(2-fluoroethyl)-4-methylpyridine-3-carboxamide

C9H11FN2O — CID 89026003

IUPACN-(2-fluoroethyl)-4-methylpyridine-3-carboxamide
SMILESCc1ccncc1C(=O)NCCF
InChIInChI=1S/C9H11FN2O/c1-7-2-4-11-6-8(7)9(13)12-5-3-10/h2,4,6H,3,5H2,1H3,(H,12,13)
InChIKeyAVWRCSFXNDYHTA-UHFFFAOYSA-N
MW182.20 g/mol
LogP1.09
Rot. Bonds3

About N-(2-fluoroethyl)-4-methylpyridine-3-carboxamide

N-(2-fluoroethyl)-4-methylpyridine-3-carboxamide (PubChem CID 89026003) has the molecular formula C9H11FN2O and a molecular weight of 182.20 g/mol. Its IUPAC name is N-(2-fluoroethyl)-4-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-fluoroethyl)-4-methylpyridine-3-carboxamide
PubChem CID89026003
Molecular FormulaC9H11FN2O
Molecular Weight182.20 g/mol
Exact Mass182.09
IUPAC NameN-(2-fluoroethyl)-4-methylpyridine-3-carboxamide
SMILESCc1ccncc1C(=O)NCCF
InChIInChI=1S/C9H11FN2O/c1-7-2-4-11-6-8(7)9(13)12-5-3-10/h2,4,6H,3,5H2,1H3,(H,12,13)
InChIKeyAVWRCSFXNDYHTA-UHFFFAOYSA-N
XLogP1.09
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.20
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-2-methylpropyl)-4-methylpyridine-3-carboxamide
CID 110833937
N-(1-chloro-2-methylpropan-2-yl)-4-methylpyridine-3-carboxamide
CID 164655174
methyl 4-methylpyridine-3-carboxylate
CID 10877301
N-(3-fluorocyclopentyl)-4-methylpyridine-3-carboxamide
CID 126785348
N-(4-ethylphenyl)-4-methylpyridine-3-carboxamide
CID 110857788
N-(2-cyanoethyl)-3-methylpyridine-4-carboxamide
CID 130174525
4-methylpyridine-3-carbonyl chloride
CID 22386188
4-methyl-N-[2-(4-methylpyrazol-1-yl)propyl]pyridine-3-carboxamide
CID 122558961
3-N,4-N-diethylpyridine-3,4-dicarboxamide
CID 14527703
4-methyl-N-(2,3,4-trifluorophenyl)pyridine-3-carboxamide
CID 110865121
N-[2-[(2-methylbenzoyl)amino]ethyl]pyridine-3-carboxamide
CID 2985921
4-methyl-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 110860907

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-4-methylpyridine-3-carboxamide?
The IUPAC name of N-(2-fluoroethyl)-4-methylpyridine-3-carboxamide (CID 89026003) is N-(2-fluoroethyl)-4-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(2-fluoroethyl)-4-methylpyridine-3-carboxamide?
The canonical SMILES for N-(2-fluoroethyl)-4-methylpyridine-3-carboxamide is Cc1ccncc1C(=O)NCCF.
What is the InChIKey of N-(2-fluoroethyl)-4-methylpyridine-3-carboxamide?
The InChIKey is AVWRCSFXNDYHTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN2O/c1-7-2-4-11-6-8(7)9(13)12-5-3-10/h2,4,6H,3,5H2,1H3,(H,12,13).
What are the key properties of N-(2-fluoroethyl)-4-methylpyridine-3-carboxamide?
N-(2-fluoroethyl)-4-methylpyridine-3-carboxamide has a molecular weight of 182.20 g/mol, XLogP of 1.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-4-methylpyridine-3-carboxamide is sourced from PubChem (CID 89026003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).