5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide

C14H17N3O2 — CID 63722692

IUPAC5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide
SMILESCc1ccc(C(C)NC(=O)c2ccc(CN)cn2)o1
InChIInChI=1S/C14H17N3O2/c1-9-3-6-13(19-9)10(2)17-14(18)12-5-4-11(7-15)8-16-12/h3-6,8,10H,7,15H2,1-2H3,(H,17,18)
InChIKeyHEYHMVCWVUZUIP-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.93
Rot. Bonds4

About 5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide

5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide (PubChem CID 63722692) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide
PubChem CID63722692
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide
SMILESCc1ccc(C(C)NC(=O)c2ccc(CN)cn2)o1
InChIInChI=1S/C14H17N3O2/c1-9-3-6-13(19-9)10(2)17-14(18)12-5-4-11(7-15)8-16-12/h3-6,8,10H,7,15H2,1-2H3,(H,17,18)
InChIKeyHEYHMVCWVUZUIP-UHFFFAOYSA-N
XLogP1.93
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(aminomethyl)-N-[(1R)-1-phenylethyl]pyridine-2-carboxamide
CID 107863938
5-(aminomethyl)-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide
CID 115116752
5-methyl-N-[(1R)-1-(5-methylfuran-2-yl)ethyl]-1,2-oxazole-3-carboxamide
CID 94177083
N-[1-(5-methylfuran-2-yl)ethyl]-1,3-thiazole-4-carboxamide
CID 63049931
N-[1-(5-methylfuran-2-yl)ethyl]quinoxaline-2-carboxamide
CID 46443465
5-chloro-6-hydrazinyl-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
CID 62249621
5-(aminomethyl)-N-(2-methylbutyl)pyridine-2-carboxamide
CID 63723883
4-methyl-N-[1-(5-methylfuran-2-yl)ethyl]-1,3-thiazole-5-carboxamide
CID 47209094
6-fluoro-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-3-carboxamide
CID 63977964
5-(aminomethyl)-N-(2,3,3-trimethylbutyl)pyridine-2-carboxamide
CID 83142698
5-(aminomethyl)-N-methyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide
CID 63723030
5-(aminomethyl)-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide
CID 63724718

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide (CID 63722692) is 5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide is Cc1ccc(C(C)NC(=O)c2ccc(CN)cn2)o1.
What is the InChIKey of 5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide?
The InChIKey is HEYHMVCWVUZUIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-9-3-6-13(19-9)10(2)17-14(18)12-5-4-11(7-15)8-16-12/h3-6,8,10H,7,15H2,1-2H3,(H,17,18).
What are the key properties of 5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide?
5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-[1-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 63722692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).