5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide

C15H25N3O — CID 55229435

IUPAC5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide
SMILESCC(C)CN(CC(C)C)C(=O)c1ccc(CN)cn1
InChIInChI=1S/C15H25N3O/c1-11(2)9-18(10-12(3)4)15(19)14-6-5-13(7-16)8-17-14/h5-6,8,11-12H,7,9-10,16H2,1-4H3
InChIKeyQADQJOLEMNZGAR-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.29
Rot. Bonds6

About 5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide

5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide (PubChem CID 55229435) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide
PubChem CID55229435
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide
SMILESCC(C)CN(CC(C)C)C(=O)c1ccc(CN)cn1
InChIInChI=1S/C15H25N3O/c1-11(2)9-18(10-12(3)4)15(19)14-6-5-13(7-16)8-17-14/h5-6,8,11-12H,7,9-10,16H2,1-4H3
InChIKeyQADQJOLEMNZGAR-UHFFFAOYSA-N
XLogP2.29
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(aminomethyl)-N-(2-methylpropyl)-N-pentan-3-ylpyridine-2-carboxamide
CID 79483346
5-(aminomethyl)-N,N-dipropylpyridine-2-carboxamide
CID 55229815
5-(aminomethyl)-N-ethyl-N-(2-hydroxy-2-methylpropyl)pyridine-2-carboxamide
CID 79384484
5-(aminomethyl)-N-[2-(dimethylamino)-2-oxoethyl]-N-ethylpyridine-2-carboxamide
CID 63724556
5-(aminomethyl)-N-(2-methylbutyl)pyridine-2-carboxamide
CID 63723883
5-(aminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
CID 63723207
5-(aminomethyl)-N-(cyclobutylmethyl)-N-ethylpyridine-2-carboxamide
CID 107396959
5-(aminomethyl)-N-(4-fluorophenyl)-N-methylpyridine-2-carboxamide
CID 63723051
N-(2-amino-2-oxoethyl)-5-cyano-N-(2-methylpropyl)pyridine-2-carboxamide
CID 63716939
5-(aminomethyl)-N-cyclopentyl-N-ethylpyridine-2-carboxamide
CID 63723531
5-(aminomethyl)-N-(2,3,3-trimethylbutyl)pyridine-2-carboxamide
CID 83142698
5-(aminomethyl)-N-methyl-N-(2-methylphenyl)pyridine-2-carboxamide
CID 63723383

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide?
The IUPAC name of 5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide (CID 55229435) is 5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide is CC(C)CN(CC(C)C)C(=O)c1ccc(CN)cn1.
What is the InChIKey of 5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide?
The InChIKey is QADQJOLEMNZGAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-11(2)9-18(10-12(3)4)15(19)14-6-5-13(7-16)8-17-14/h5-6,8,11-12H,7,9-10,16H2,1-4H3.
What are the key properties of 5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide?
5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 2.29, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N,N-bis(2-methylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 55229435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).