N-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide

C11H17N3O — CID 110833934

IUPACN-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide
SMILESCc1ccnc(C(=O)NC(C)(C)CN)c1
InChIInChI=1S/C11H17N3O/c1-8-4-5-13-9(6-8)10(15)14-11(2,3)7-12/h4-6H,7,12H2,1-3H3,(H,14,15)
InChIKeyTZIPYPWHCNVJBI-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.86
Rot. Bonds3

About N-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide

N-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide (PubChem CID 110833934) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide
PubChem CID110833934
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide
SMILESCc1ccnc(C(=O)NC(C)(C)CN)c1
InChIInChI=1S/C11H17N3O/c1-8-4-5-13-9(6-8)10(15)14-11(2,3)7-12/h4-6H,7,12H2,1-3H3,(H,14,15)
InChIKeyTZIPYPWHCNVJBI-UHFFFAOYSA-N
XLogP0.86
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide (CID 110833934) is N-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide is Cc1ccnc(C(=O)NC(C)(C)CN)c1.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide?
The InChIKey is TZIPYPWHCNVJBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-8-4-5-13-9(6-8)10(15)14-11(2,3)7-12/h4-6H,7,12H2,1-3H3,(H,14,15).
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide?
N-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide has a molecular weight of 207.28 g/mol, XLogP of 0.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-4-methylpyridine-2-carboxamide is sourced from PubChem (CID 110833934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).