N-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide

C18H21F2N3O — CID 109175949

IUPACN-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide
SMILESCCCN(CCC)c1cc(C(=O)Nc2ccc(F)cc2F)ccn1
InChIInChI=1S/C18H21F2N3O/c1-3-9-23(10-4-2)17-11-13(7-8-21-17)18(24)22-16-6-5-14(19)12-15(16)20/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,22,24)
InChIKeyBBVMGFGNMOIZCP-UHFFFAOYSA-N
MW333.38 g/mol
LogP4.24
Rot. Bonds7

About N-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide

N-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide (PubChem CID 109175949) has the molecular formula C18H21F2N3O and a molecular weight of 333.38 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide
PubChem CID109175949
Molecular FormulaC18H21F2N3O
Molecular Weight333.38 g/mol
Exact Mass333.17
IUPAC NameN-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide
SMILESCCCN(CCC)c1cc(C(=O)Nc2ccc(F)cc2F)ccn1
InChIInChI=1S/C18H21F2N3O/c1-3-9-23(10-4-2)17-11-13(7-8-21-17)18(24)22-16-6-5-14(19)12-15(16)20/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,22,24)
InChIKeyBBVMGFGNMOIZCP-UHFFFAOYSA-N
XLogP4.24
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.38
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(dipropylamino)-N-(2,3,4-trifluorophenyl)pyridine-4-carboxamide
CID 109175957
N-(5-chloro-2-methoxyphenyl)-2-(dipropylamino)pyridine-4-carboxamide
CID 109175912
2-(aminomethyl)-N-(2,4-difluorophenyl)pyridine-4-carboxamide
CID 114325533
N-(4-bromophenyl)-2-(dipropylamino)pyridine-4-carboxamide
CID 109175913
N-(3,4-dimethylphenyl)-2-(dipropylamino)pyridine-4-carboxamide
CID 109175898
N-tert-butyl-2-(dipropylamino)pyridine-4-carboxamide
CID 109174998
2-(dipropylamino)-N-(4-ethoxyphenyl)pyridine-4-carboxamide
CID 109175918
4-N-(2,4-difluorophenyl)-2-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092315
3-N-(2,4-difluorophenyl)-5-N,5-N-dipropylpyridine-3,5-dicarboxamide
CID 109107640
2-N-(2,4-difluorophenyl)-4-N,4-N-diethylpyridine-2,4-dicarboxamide
CID 109088871
2-cyano-N-(2,4-difluorophenyl)pyridine-4-carboxamide
CID 115115799
1-N,4-N-bis(2,4-difluorophenyl)benzene-1,4-dicarboxamide
CID 3596826

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide (CID 109175949) is N-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide is CCCN(CCC)c1cc(C(=O)Nc2ccc(F)cc2F)ccn1.
What is the InChIKey of N-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide?
The InChIKey is BBVMGFGNMOIZCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21F2N3O/c1-3-9-23(10-4-2)17-11-13(7-8-21-17)18(24)22-16-6-5-14(19)12-15(16)20/h5-8,11-12H,3-4,9-10H2,1-2H3,(H,22,24).
What are the key properties of N-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide?
N-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide has a molecular weight of 333.38 g/mol, XLogP of 4.24, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-2-(dipropylamino)pyridine-4-carboxamide is sourced from PubChem (CID 109175949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).