2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide

C10H14F2N4O2 — CID 114195454

IUPAC2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide
SMILESNC(=O)c1cc(N)ncc1N(CCO)CC(F)F
InChIInChI=1S/C10H14F2N4O2/c11-8(12)5-16(1-2-17)7-4-15-9(13)3-6(7)10(14)18/h3-4,8,17H,1-2,5H2,(H2,13,15)(H2,14,18)
InChIKeyLBIHRCIRWFAVNV-UHFFFAOYSA-N
MW260.24 g/mol
LogP-0.17
Rot. Bonds6

About 2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide

2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide (PubChem CID 114195454) has the molecular formula C10H14F2N4O2 and a molecular weight of 260.24 g/mol. Its IUPAC name is 2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide
PubChem CID114195454
Molecular FormulaC10H14F2N4O2
Molecular Weight260.24 g/mol
Exact Mass260.11
IUPAC Name2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide
SMILESNC(=O)c1cc(N)ncc1N(CCO)CC(F)F
InChIInChI=1S/C10H14F2N4O2/c11-8(12)5-16(1-2-17)7-4-15-9(13)3-6(7)10(14)18/h3-4,8,17H,1-2,5H2,(H2,13,15)(H2,14,18)
InChIKeyLBIHRCIRWFAVNV-UHFFFAOYSA-N
XLogP-0.17
TPSA105.47 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.24
LogP ≤ 5-0.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol
CID 107495031
2-amino-5-[methyl(3,3,3-trifluoropropyl)amino]pyridine-4-carboxamide
CID 114195200
2-[(5-amino-3-methyl-2-pyridinyl)-(2,2-difluoroethyl)amino]ethanol
CID 107478248
2-[(5-amino-1H-indazol-6-yl)-(2,2-difluoroethyl)amino]ethanol
CID 107491312
2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-5-(trifluoromethyl)benzenecarbothioamide
CID 107479827
2-[4-amino-N-(2,2-difluoroethyl)-2-iodoanilino]ethanol
CID 107478099
2-amino-5-[methyl(1-thiophen-2-ylethyl)amino]pyridine-4-carboxamide
CID 114194969
ethyl 2-amino-5-[ethyl(3-hydroxypropyl)amino]pyridine-4-carboxylate
CID 114195355
2-[[5-(aminomethyl)pyrazin-2-yl]-(2,2-difluoroethyl)amino]ethanol
CID 107478418
2-[(5-chloropyrimidin-2-yl)-(2,2-difluoroethyl)amino]ethanol
CID 107484163
4-[2,2-difluoroethyl(2-hydroxyethyl)amino]-3,5-difluorobenzoic acid
CID 107480412
2-amino-5-[cyclohexylmethyl(methyl)amino]pyridine-4-carboxamide
CID 114194912

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide?
The IUPAC name of 2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide (CID 114195454) is 2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide is NC(=O)c1cc(N)ncc1N(CCO)CC(F)F.
What is the InChIKey of 2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide?
The InChIKey is LBIHRCIRWFAVNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F2N4O2/c11-8(12)5-16(1-2-17)7-4-15-9(13)3-6(7)10(14)18/h3-4,8,17H,1-2,5H2,(H2,13,15)(H2,14,18).
What are the key properties of 2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide?
2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide has a molecular weight of 260.24 g/mol, XLogP of -0.17, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide is sourced from PubChem (CID 114195454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).