N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide

C13H15N3O2 — CID 79095429

IUPACN-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide
SMILESCCc1ccc(C(=O)Nc2ccc(CN)cn2)o1
InChIInChI=1S/C13H15N3O2/c1-2-10-4-5-11(18-10)13(17)16-12-6-3-9(7-14)8-15-12/h3-6,8H,2,7,14H2,1H3,(H,15,16,17)
InChIKeyGFAXQLVHECJSQT-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.95
Rot. Bonds4

About N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide

N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide (PubChem CID 79095429) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide
PubChem CID79095429
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC NameN-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide
SMILESCCc1ccc(C(=O)Nc2ccc(CN)cn2)o1
InChIInChI=1S/C13H15N3O2/c1-2-10-4-5-11(18-10)13(17)16-12-6-3-9(7-14)8-15-12/h3-6,8H,2,7,14H2,1H3,(H,15,16,17)
InChIKeyGFAXQLVHECJSQT-UHFFFAOYSA-N
XLogP1.95
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[(5-chloro-2-pyridinyl)carbamoyl]phenyl]-5-ethylfuran-2-carboxamide
CID 52867425
N-[5-(aminomethyl)-2-pyridinyl]-4-methylbenzamide
CID 55063231
N-(4-chloro-2-pyridinyl)-5-ethylfuran-2-carboxamide
CID 115626699
N-[5-(aminomethyl)-2-pyridinyl]-1,3-diethylpyrazole-5-carboxamide
CID 66122725
N-(5-tert-butyl-1H-pyrazol-3-yl)-5-ethylfuran-2-carboxamide
CID 47343724
N-[5-(aminomethyl)-2-pyridinyl]-2-fluoro-3-methylbenzamide
CID 81481667
N-[5-(aminomethyl)-2-pyridinyl]-3-methoxybenzamide
CID 62350444
5-ethyl-N-methylfuran-2-carboxamide
CID 60751451
1-[5-(aminomethyl)-2-pyridinyl]-3-butylurea
CID 62354751
5-ethyl-N-[4-(hydroxymethyl)phenyl]furan-2-carboxamide
CID 64793917
N-[5-(aminomethyl)-2-pyridinyl]-2,4-difluorobenzamide
CID 62350431
N-(2-amino-5-methylphenyl)-5-ethylfuran-2-carboxamide
CID 112557315

Frequently Asked Questions

What is the IUPAC name of N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide?
The IUPAC name of N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide (CID 79095429) is N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide.
What is the SMILES notation for N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide?
The canonical SMILES for N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide is CCc1ccc(C(=O)Nc2ccc(CN)cn2)o1.
What is the InChIKey of N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide?
The InChIKey is GFAXQLVHECJSQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-2-10-4-5-11(18-10)13(17)16-12-6-3-9(7-14)8-15-12/h3-6,8H,2,7,14H2,1H3,(H,15,16,17).
What are the key properties of N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide?
N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide has a molecular weight of 245.28 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(aminomethyl)-2-pyridinyl]-5-ethylfuran-2-carboxamide is sourced from PubChem (CID 79095429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).