2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine

C14H30N2O — CID 103226831

IUPAC2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine
SMILESCOCC(CNC(C)C)N1CC(C)CCC1C
InChIInChI=1S/C14H30N2O/c1-11(2)15-8-14(10-17-5)16-9-12(3)6-7-13(16)4/h11-15H,6-10H2,1-5H3
InChIKeyYWOSUKGZKVYWEX-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.12
Rot. Bonds6

About 2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine

2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine (PubChem CID 103226831) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound Name2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine
PubChem CID103226831
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine
SMILESCOCC(CNC(C)C)N1CC(C)CCC1C
InChIInChI=1S/C14H30N2O/c1-11(2)15-8-14(10-17-5)16-9-12(3)6-7-13(16)4/h11-15H,6-10H2,1-5H3
InChIKeyYWOSUKGZKVYWEX-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-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-methoxy-2-(2-methylpyrrolidin-1-yl)-N-propan-2-ylpropan-1-amine
CID 103225175
3-methoxy-N-propan-2-yl-2-(3,4,5-trimethylpiperazin-1-yl)propan-1-amine
CID 103227363
2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-1-amine
CID 103227314
2-(5-ethyl-2-methylmorpholin-4-yl)-3-methoxy-N-propan-2-ylpropan-1-amine
CID 103226255
3-methoxy-N-propan-2-yl-2-(4-propan-2-ylpiperidin-1-yl)propan-1-amine
CID 103503291
N-[2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxypropyl]-2-methylpropan-2-amine
CID 103227315
3-methoxy-N-methyl-2-(2-methylpiperidin-1-yl)propan-1-amine
CID 103225220
3-methoxy-2-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propan-2-ylpropan-1-amine
CID 103225921
2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-3-methoxy-N-propan-2-ylpropan-1-amine
CID 103226460
2-(2,4-dimethylpiperidin-1-yl)-N-propan-2-ylpentan-1-amine
CID 83054193
2-(2,4-dimethylpyrrolidin-1-yl)-3-methoxypropan-1-amine
CID 103227319
2-(2,4-dimethylpiperidin-1-yl)-3-methoxy-N-methylpropan-1-amine
CID 103225963

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine?
The IUPAC name of 2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine (CID 103226831) is 2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for 2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine?
The canonical SMILES for 2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine is COCC(CNC(C)C)N1CC(C)CCC1C.
What is the InChIKey of 2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine?
The InChIKey is YWOSUKGZKVYWEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-11(2)15-8-14(10-17-5)16-9-12(3)6-7-13(16)4/h11-15H,6-10H2,1-5H3.
What are the key properties of 2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine?
2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine has a molecular weight of 242.41 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylpiperidin-1-yl)-3-methoxy-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 103226831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).