N-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide

C13H21N3O — CID 79652120

IUPACN-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(C)CC(C)(C)CN)cn1
InChIInChI=1S/C13H21N3O/c1-10-5-6-11(7-15-10)12(17)16(4)9-13(2,3)8-14/h5-7H,8-9,14H2,1-4H3
InChIKeyKUIKCPXIRDWFPV-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.45
Rot. Bonds4

About N-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide

N-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide (PubChem CID 79652120) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide
PubChem CID79652120
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC NameN-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide
SMILESCc1ccc(C(=O)N(C)CC(C)(C)CN)cn1
InChIInChI=1S/C13H21N3O/c1-10-5-6-11(7-15-10)12(17)16(4)9-13(2,3)8-14/h5-7H,8-9,14H2,1-4H3
InChIKeyKUIKCPXIRDWFPV-UHFFFAOYSA-N
XLogP1.45
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-(3-amino-2,2-dimethylpropyl)-4-N-methylbenzene-1,4-dicarboxamide
CID 119656143
N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 119654094
N-(3-amino-2,2-dimethylpropyl)-N-methylpyridine-4-carboxamide;dihydrochloride
CID 119653576
N-(3-amino-2,2-dimethylpropyl)-N-methyl-4-methylsulfanylbenzamide
CID 79651919
N-(3-amino-2,2-dimethylpropyl)-4-(2-methoxyethoxy)-N-methylbenzamide
CID 119654669
N-(3-amino-2,2-dimethylpropyl)-N-methyl-4-(4-methylpyrazol-1-yl)benzamide;hydrochloride
CID 119653973
N-(3-amino-2,2-dimethylpropyl)-N,3-dimethyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide
CID 119653779
N-(3-amino-2,2-dimethylpropyl)-N,3-dimethyl-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide;hydrochloride
CID 119653778
methyl 2-[methyl-(6-methylpyridine-3-carbonyl)amino]acetate
CID 43409840
N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxo-1H-pyridine-3-carboxamide
CID 79652401
N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxopyran-3-carboxamide
CID 79652485
N-(3-amino-2,2-dimethylpropyl)-N-methyl-4-(sulfamoylmethyl)benzamide;hydrochloride
CID 119652729

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide?
The IUPAC name of N-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide (CID 79652120) is N-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide?
The canonical SMILES for N-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide is Cc1ccc(C(=O)N(C)CC(C)(C)CN)cn1.
What is the InChIKey of N-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide?
The InChIKey is KUIKCPXIRDWFPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-10-5-6-11(7-15-10)12(17)16(4)9-13(2,3)8-14/h5-7H,8-9,14H2,1-4H3.
What are the key properties of N-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide?
N-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide has a molecular weight of 235.33 g/mol, XLogP of 1.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethylpropyl)-N,6-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 79652120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).