(3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone

C15H22N2O — CID 115269313

IUPAC(3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone
SMILESCc1ccccc1C(=O)N1CCCC(N)C1(C)C
InChIInChI=1S/C15H22N2O/c1-11-7-4-5-8-12(11)14(18)17-10-6-9-13(16)15(17,2)3/h4-5,7-8,13H,6,9-10,16H2,1-3H3
InChIKeyCOJNIKSBCFAMQF-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.34
Rot. Bonds1

About (3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone

(3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone (PubChem CID 115269313) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is (3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone.

Molecular Properties

Compound Name(3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone
PubChem CID115269313
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name(3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone
SMILESCc1ccccc1C(=O)N1CCCC(N)C1(C)C
InChIInChI=1S/C15H22N2O/c1-11-7-4-5-8-12(11)14(18)17-10-6-9-13(16)15(17,2)3/h4-5,7-8,13H,6,9-10,16H2,1-3H3
InChIKeyCOJNIKSBCFAMQF-UHFFFAOYSA-N
XLogP2.34
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone 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-amino-2,2-dimethylpyrrolidin-1-yl)-naphthalen-1-ylmethanone
CID 115275261
(3-amino-2,2-dimethylpiperidin-1-yl)-(2,5-difluorophenyl)methanone
CID 115275913
(3-amino-2,2-dimethylpiperidin-1-yl)-(1H-pyrrol-2-yl)methanone
CID 115275915
(4-aminopiperidin-1-yl)-(2-methylphenyl)methanone;hydrochloride
CID 119372796
(3-amino-2,2-dimethylpyrrolidin-1-yl)-(2,4,6-trimethylphenyl)methanone
CID 115275240
(5-hydroxy-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone
CID 115269397
(2-ethylpyrrolidin-1-yl)-(2-methylphenyl)methanone
CID 110604637
(3-amino-2,2-dimethylpyrrolidin-1-yl)-(2,5-difluorophenyl)methanone
CID 115275242
azepan-1-yl-(2-methylphenyl)methanone
CID 4616576
(4,4-dimethyl-1,3-oxazolidin-3-yl)-(2-methylphenyl)methanone
CID 110740609
(2-methylphenyl)-(2-piperidin-4-ylpyrrolidin-1-yl)methanone
CID 60979228
[2-(bromomethyl)azepan-1-yl]-(2-methylphenyl)methanone
CID 116639448

Frequently Asked Questions

What is the IUPAC name of (3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone?
The IUPAC name of (3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone (CID 115269313) is (3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone.
What is the SMILES notation for (3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone?
The canonical SMILES for (3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone is Cc1ccccc1C(=O)N1CCCC(N)C1(C)C.
What is the InChIKey of (3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone?
The InChIKey is COJNIKSBCFAMQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-11-7-4-5-8-12(11)14(18)17-10-6-9-13(16)15(17,2)3/h4-5,7-8,13H,6,9-10,16H2,1-3H3.
What are the key properties of (3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone?
(3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone has a molecular weight of 246.35 g/mol, XLogP of 2.34, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-2,2-dimethylpiperidin-1-yl)-(2-methylphenyl)methanone is sourced from PubChem (CID 115269313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).