6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride

C13H18ClN5O — CID 119999079

IUPAC6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride
SMILESCC(C)Cn1ccnc1NC(=O)c1cccc(N)n1.Cl
InChIInChI=1S/C13H17N5O.ClH/c1-9(2)8-18-7-6-15-13(18)17-12(19)10-4-3-5-11(14)16-10;/h3-7,9H,8H2,1-2H3,(H2,14,16)(H,15,17,19);1H
InChIKeyPNXIVPHRMFJMRQ-UHFFFAOYSA-N
MW295.77 g/mol
LogP2.19
Rot. Bonds4

About 6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride

6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride (PubChem CID 119999079) has the molecular formula C13H18ClN5O and a molecular weight of 295.77 g/mol. Its IUPAC name is 6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride
PubChem CID119999079
Molecular FormulaC13H18ClN5O
Molecular Weight295.77 g/mol
Exact Mass295.12
IUPAC Name6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride
SMILESCC(C)Cn1ccnc1NC(=O)c1cccc(N)n1.Cl
InChIInChI=1S/C13H17N5O.ClH/c1-9(2)8-18-7-6-15-13(18)17-12(19)10-4-3-5-11(14)16-10;/h3-7,9H,8H2,1-2H3,(H2,14,16)(H,15,17,19);1H
InChIKeyPNXIVPHRMFJMRQ-UHFFFAOYSA-N
XLogP2.19
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.77
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride?
The IUPAC name of 6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride (CID 119999079) is 6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride.
What is the SMILES notation for 6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride?
The canonical SMILES for 6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride is CC(C)Cn1ccnc1NC(=O)c1cccc(N)n1.Cl.
What is the InChIKey of 6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride?
The InChIKey is PNXIVPHRMFJMRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O.ClH/c1-9(2)8-18-7-6-15-13(18)17-12(19)10-4-3-5-11(14)16-10;/h3-7,9H,8H2,1-2H3,(H2,14,16)(H,15,17,19);1H.
What are the key properties of 6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride?
6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride has a molecular weight of 295.77 g/mol, XLogP of 2.19, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[1-(2-methylpropyl)imidazol-2-yl]pyridine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119999079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).