6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride

C13H20ClN3O — CID 119999178

IUPAC6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride
SMILESCC(C)C1(CNC(=O)c2cccc(N)n2)CC1.Cl
InChIInChI=1S/C13H19N3O.ClH/c1-9(2)13(6-7-13)8-15-12(17)10-4-3-5-11(14)16-10;/h3-5,9H,6-8H2,1-2H3,(H2,14,16)(H,15,17);1H
InChIKeyCHMCKNUZUGJKDG-UHFFFAOYSA-N
MW269.78 g/mol
LogP2.25
Rot. Bonds4

About 6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride

6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride (PubChem CID 119999178) has the molecular formula C13H20ClN3O and a molecular weight of 269.78 g/mol. Its IUPAC name is 6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride
PubChem CID119999178
Molecular FormulaC13H20ClN3O
Molecular Weight269.78 g/mol
Exact Mass269.13
IUPAC Name6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride
SMILESCC(C)C1(CNC(=O)c2cccc(N)n2)CC1.Cl
InChIInChI=1S/C13H19N3O.ClH/c1-9(2)13(6-7-13)8-15-12(17)10-4-3-5-11(14)16-10;/h3-5,9H,6-8H2,1-2H3,(H2,14,16)(H,15,17);1H
InChIKeyCHMCKNUZUGJKDG-UHFFFAOYSA-N
XLogP2.25
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.78
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride?
The IUPAC name of 6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride (CID 119999178) is 6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride.
What is the SMILES notation for 6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride?
The canonical SMILES for 6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride is CC(C)C1(CNC(=O)c2cccc(N)n2)CC1.Cl.
What is the InChIKey of 6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride?
The InChIKey is CHMCKNUZUGJKDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O.ClH/c1-9(2)13(6-7-13)8-15-12(17)10-4-3-5-11(14)16-10;/h3-5,9H,6-8H2,1-2H3,(H2,14,16)(H,15,17);1H.
What are the key properties of 6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride?
6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride has a molecular weight of 269.78 g/mol, XLogP of 2.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[(1-propan-2-ylcyclopropyl)methyl]pyridine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119999178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).