5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide

C14H16ClN3O3 — CID 133353158

IUPAC5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide
SMILESCc1ccc(C(C)(O)CNc2ncc(C(N)=O)cc2Cl)o1
InChIInChI=1S/C14H16ClN3O3/c1-8-3-4-11(21-8)14(2,20)7-18-13-10(15)5-9(6-17-13)12(16)19/h3-6,20H,7H2,1-2H3,(H2,16,19)(H,17,18)
InChIKeyBOBFAGOCAUMJFR-UHFFFAOYSA-N
MW309.75 g/mol
LogP2.05
Rot. Bonds5

About 5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide

5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide (PubChem CID 133353158) has the molecular formula C14H16ClN3O3 and a molecular weight of 309.75 g/mol. Its IUPAC name is 5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide
PubChem CID133353158
Molecular FormulaC14H16ClN3O3
Molecular Weight309.75 g/mol
Exact Mass309.09
IUPAC Name5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide
SMILESCc1ccc(C(C)(O)CNc2ncc(C(N)=O)cc2Cl)o1
InChIInChI=1S/C14H16ClN3O3/c1-8-3-4-11(21-8)14(2,20)7-18-13-10(15)5-9(6-17-13)12(16)19/h3-6,20H,7H2,1-2H3,(H2,16,19)(H,17,18)
InChIKeyBOBFAGOCAUMJFR-UHFFFAOYSA-N
XLogP2.05
TPSA101.38 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.75
LogP ≤ 52.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

[5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]-3-pyridinyl]-piperidin-1-ylmethanone
CID 133353084
5-chloro-6-[(2-methyl-2-methylsulfanylpropyl)amino]pyridine-3-carboxamide
CID 133327417
ethyl 6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxylate
CID 133353047
5-chloro-6-[(2-methylpyrimidin-4-yl)methylamino]pyridine-3-carboxamide
CID 47059518
6-[(4-bromophenyl)methylamino]-5-chloropyridine-3-carboxamide
CID 133292879
2-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carbonitrile
CID 133353245
4-[(5-carbamoyl-3-chloro-2-pyridinyl)amino]butanoic acid
CID 122058630
5-chloro-6-[[2-hydroxy-2-(3-methylphenyl)ethyl]amino]pyridine-3-carboxamide
CID 133375865
5-chloro-6-[[4-(2-methylphenyl)oxan-4-yl]methylamino]pyridine-3-carboxamide
CID 133272354
5-chloro-6-[(6-methylimidazo[1,2-a]pyridin-2-yl)methylamino]pyridine-3-carboxamide
CID 56816532
5-chloro-6-[(4-hydroxyoxan-4-yl)methylamino]pyridine-3-carboxamide
CID 133294647
5-chloro-6-[(1,1-dioxothiolan-3-yl)methylamino]pyridine-3-carboxamide
CID 47292812

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide?
The IUPAC name of 5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide (CID 133353158) is 5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide is Cc1ccc(C(C)(O)CNc2ncc(C(N)=O)cc2Cl)o1.
What is the InChIKey of 5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide?
The InChIKey is BOBFAGOCAUMJFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClN3O3/c1-8-3-4-11(21-8)14(2,20)7-18-13-10(15)5-9(6-17-13)12(16)19/h3-6,20H,7H2,1-2H3,(H2,16,19)(H,17,18).
What are the key properties of 5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide?
5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide has a molecular weight of 309.75 g/mol, XLogP of 2.05, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxamide is sourced from PubChem (CID 133353158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).