5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide

C12H19N3O — CID 63724390

IUPAC5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide
SMILESCC(C)(C)CNC(=O)c1ccc(CN)cn1
InChIInChI=1S/C12H19N3O/c1-12(2,3)8-15-11(16)10-5-4-9(6-13)7-14-10/h4-5,7H,6,8,13H2,1-3H3,(H,15,16)
InChIKeyPNXBUQRLFZGCAX-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.32
Rot. Bonds3

About 5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide

5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide (PubChem CID 63724390) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide
PubChem CID63724390
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide
SMILESCC(C)(C)CNC(=O)c1ccc(CN)cn1
InChIInChI=1S/C12H19N3O/c1-12(2,3)8-15-11(16)10-5-4-9(6-13)7-14-10/h4-5,7H,6,8,13H2,1-3H3,(H,15,16)
InChIKeyPNXBUQRLFZGCAX-UHFFFAOYSA-N
XLogP1.32
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(aminomethyl)-N-(2,3,3-trimethylbutyl)pyridine-2-carboxamide
CID 83142698
5-(aminomethyl)-N-[2-(tert-butylamino)-2-oxoethyl]pyridine-2-carboxamide
CID 115355859
5-(aminomethyl)-N-benzylpyridine-2-carboxamide
CID 55230776
5-(aminomethyl)-N-(2-methylbutyl)pyridine-2-carboxamide
CID 63723883
5-(aminomethyl)-N-[3-(diethylamino)propyl]pyridine-2-carboxamide
CID 63723354
5-(aminomethyl)-N-(1H-pyrazol-4-ylmethyl)pyridine-2-carboxamide
CID 63722358
5-(aminomethyl)-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-2-carboxamide
CID 79351403
5-(aminomethyl)-N-(3-cyclopentylpropyl)pyridine-2-carboxamide
CID 106016244
N-(2,2-dimethylpropyl)-5-hydrazinylpyrazine-2-carboxamide
CID 107377627
5-(aminomethyl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide
CID 79384484
5-(aminomethyl)-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide
CID 115116752
5-(aminomethyl)-N-(3-ethylphenyl)pyridine-2-carboxamide
CID 55230586

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide?
The IUPAC name of 5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide (CID 63724390) is 5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide is CC(C)(C)CNC(=O)c1ccc(CN)cn1.
What is the InChIKey of 5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide?
The InChIKey is PNXBUQRLFZGCAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-12(2,3)8-15-11(16)10-5-4-9(6-13)7-14-10/h4-5,7H,6,8,13H2,1-3H3,(H,15,16).
What are the key properties of 5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide?
5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide has a molecular weight of 221.30 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-(2,2-dimethylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 63724390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).