N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine

C12H20N2 — CID 115922281

IUPACN-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine
SMILESCc1cncc(NC(C)C(C)(C)C)c1
InChIInChI=1S/C12H20N2/c1-9-6-11(8-13-7-9)14-10(2)12(3,4)5/h6-8,10,14H,1-5H3
InChIKeyMSZDOLCLEGDUBN-UHFFFAOYSA-N
MW192.31 g/mol
LogP3.24
Rot. Bonds2

About N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine

N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine (PubChem CID 115922281) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine.

Molecular Properties

Compound NameN-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine
PubChem CID115922281
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC NameN-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine
SMILESCc1cncc(NC(C)C(C)(C)C)c1
InChIInChI=1S/C12H20N2/c1-9-6-11(8-13-7-9)14-10(2)12(3,4)5/h6-8,10,14H,1-5H3
InChIKeyMSZDOLCLEGDUBN-UHFFFAOYSA-N
XLogP3.24
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(5-bromo-3-pyridinyl)amino]-2-methylbutan-2-ol
CID 130486029
N-(3-methoxybutan-2-yl)-5-methylpyridin-3-amine
CID 115922293
N-(1-cyclopentylethyl)-5-methylpyridin-3-amine
CID 115922263
N-(3,3-dimethylbutan-2-yl)-6-methylpyridin-3-amine
CID 115921577
5-methyl-N-octan-2-ylpyridin-3-amine
CID 107584780
5-methyl-N-(1-pyridin-2-ylethyl)pyridin-3-amine
CID 115922253
N-[1-[4-(dimethylamino)phenyl]ethyl]-5-methylpyridin-3-amine
CID 103932325
N-(1-methoxybutan-2-yl)-5-methylpyridin-3-amine
CID 115922303
2-methyl-N-[1-(5-methyl-3-pyridinyl)ethyl]propan-2-amine
CID 130660349
N,N-dimethyl-3-[(5-methyl-3-pyridinyl)amino]butanamide
CID 115922299
N-[1-[2-(difluoromethoxy)phenyl]ethyl]-5-methylpyridin-3-amine
CID 103932280
3,5-dibromo-N-(3,3-dimethylbutan-2-yl)pyridin-2-amine
CID 104828759

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine?
The IUPAC name of N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine (CID 115922281) is N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine.
What is the SMILES notation for N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine?
The canonical SMILES for N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine is Cc1cncc(NC(C)C(C)(C)C)c1.
What is the InChIKey of N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine?
The InChIKey is MSZDOLCLEGDUBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-9-6-11(8-13-7-9)14-10(2)12(3,4)5/h6-8,10,14H,1-5H3.
What are the key properties of N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine?
N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine has a molecular weight of 192.31 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylbutan-2-yl)-5-methylpyridin-3-amine is sourced from PubChem (CID 115922281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).