N-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide

C13H15N3O2 — CID 61358427

IUPACN-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide
SMILESCc1cc(C(=O)N(C)c2ccncc2N)c(C)o1
InChIInChI=1S/C13H15N3O2/c1-8-6-10(9(2)18-8)13(17)16(3)12-4-5-15-7-11(12)14/h4-7H,14H2,1-3H3
InChIKeyATSYOXIBOANGKE-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.15
Rot. Bonds2

About N-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide

N-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide (PubChem CID 61358427) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is N-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide
PubChem CID61358427
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC NameN-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide
SMILESCc1cc(C(=O)N(C)c2ccncc2N)c(C)o1
InChIInChI=1S/C13H15N3O2/c1-8-6-10(9(2)18-8)13(17)16(3)12-4-5-15-7-11(12)14/h4-7H,14H2,1-3H3
InChIKeyATSYOXIBOANGKE-UHFFFAOYSA-N
XLogP2.15
TPSA72.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-amino-4-pyridinyl)-3-chloro-N-methylpyridine-4-carboxamide
CID 66462789
N-(3-amino-4-pyridinyl)-N,3,5-trimethylbenzamide
CID 61359205
N-(3-amino-4-pyridinyl)-2,4-dimethoxy-N-methylbenzamide
CID 61359400
N-(3-amino-4-pyridinyl)-2-bromo-N-methylbenzamide
CID 61360177
N-(3-amino-4-pyridinyl)-3-methoxy-N-methylpyridine-4-carboxamide
CID 105063003
N-(3-amino-4-pyridinyl)-5-bromo-2-hydroxy-N-methylbenzamide
CID 107729224
N-(3-amino-4-pyridinyl)-3,5-dibromo-N-methylbenzamide
CID 107971013
N-(3-amino-4-pyridinyl)-3,4-dichloro-N-methylbenzamide
CID 61358233
N-(3-amino-4-pyridinyl)-N-methylquinoline-5-carboxamide
CID 62848464
N-(3-amino-4-pyridinyl)-3-chloro-4-hydroxy-N-methylbenzamide
CID 61357841
N-(2-aminophenyl)-3-hydroxy-N-methylpyridine-4-carboxamide
CID 81446196
3-amino-N-methyl-N-(4-methylphenyl)pyridine-4-carboxamide
CID 105069166

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide?
The IUPAC name of N-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide (CID 61358427) is N-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide.
What is the SMILES notation for N-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide?
The canonical SMILES for N-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide is Cc1cc(C(=O)N(C)c2ccncc2N)c(C)o1.
What is the InChIKey of N-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide?
The InChIKey is ATSYOXIBOANGKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-8-6-10(9(2)18-8)13(17)16(3)12-4-5-15-7-11(12)14/h4-7H,14H2,1-3H3.
What are the key properties of N-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide?
N-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide has a molecular weight of 245.28 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-pyridinyl)-N,2,5-trimethylfuran-3-carboxamide is sourced from PubChem (CID 61358427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).