N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine

C12H18N2 — CID 131047920

IUPACN-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine
SMILESCc1ccnc(NC2CC(C)(C)C2)c1
InChIInChI=1S/C12H18N2/c1-9-4-5-13-11(6-9)14-10-7-12(2,3)8-10/h4-6,10H,7-8H2,1-3H3,(H,13,14)
InChIKeyMBCBBTQWJIQZEG-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.99
Rot. Bonds2

About N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine

N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine (PubChem CID 131047920) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine.

Molecular Properties

Compound NameN-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine
PubChem CID131047920
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC NameN-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine
SMILESCc1ccnc(NC2CC(C)(C)C2)c1
InChIInChI=1S/C12H18N2/c1-9-4-5-13-11(6-9)14-10-7-12(2,3)8-10/h4-6,10H,7-8H2,1-3H3,(H,13,14)
InChIKeyMBCBBTQWJIQZEG-UHFFFAOYSA-N
XLogP2.99
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-4-methylpyridin-2-amine;ethane
CID 170575903
4-[(4-methyl-2-pyridinyl)amino]cyclohexan-1-ol
CID 58548584
4-methyl-N-[(3R)-piperidin-3-yl]pyridin-2-amine;hydrochloride
CID 71638526
4-methyl-N-(1-methylsulfonylpiperidin-4-yl)pyridin-2-amine
CID 90245389
6-N-methyl-4-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidine-4,6-diamine
CID 103968628
5-fluoro-N-(3,3,5,5-tetramethylcyclohexyl)pyridin-2-amine
CID 103967192
2-methyl-1-[3-[(4-methyl-2-pyridinyl)amino]azetidin-1-yl]propan-1-one
CID 90245415
2-[4-[(4-methyl-2-pyridinyl)amino]piperidin-1-yl]acetonitrile
CID 63626089
N,4-dimethylpyridin-2-amine;hydrochloride
CID 54595444
6-methoxy-2-methyl-N-(3,3,5,5-tetramethylcyclohexyl)pyrimidin-4-amine
CID 103967188
1-cyclopropyl-3-(4-methyl-2-pyridinyl)urea
CID 108887621
4-methyl-N-[(2-methylcyclobutyl)methyl]pyridin-2-amine
CID 130848876

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine?
The IUPAC name of N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine (CID 131047920) is N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine.
What is the SMILES notation for N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine?
The canonical SMILES for N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine is Cc1ccnc(NC2CC(C)(C)C2)c1.
What is the InChIKey of N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine?
The InChIKey is MBCBBTQWJIQZEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-9-4-5-13-11(6-9)14-10-7-12(2,3)8-10/h4-6,10H,7-8H2,1-3H3,(H,13,14).
What are the key properties of N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine?
N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine has a molecular weight of 190.29 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylcyclobutyl)-4-methylpyridin-2-amine is sourced from PubChem (CID 131047920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).