N-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine

C19H25N3O2 — CID 122144100

IUPACN-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine
SMILESCOc1cc(NC2CCN(c3cc(C)ccn3)CC2)cc(OC)c1
InChIInChI=1S/C19H25N3O2/c1-14-4-7-20-19(10-14)22-8-5-15(6-9-22)21-16-11-17(23-2)13-18(12-16)24-3/h4,7,10-13,15,21H,5-6,8-9H2,1-3H3
InChIKeyGLILFGYNAOMCBX-UHFFFAOYSA-N
MW327.43 g/mol
LogP3.49
Rot. Bonds5

About N-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine

N-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine (PubChem CID 122144100) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is N-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine.

Molecular Properties

Compound NameN-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine
PubChem CID122144100
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC NameN-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine
SMILESCOc1cc(NC2CCN(c3cc(C)ccn3)CC2)cc(OC)c1
InChIInChI=1S/C19H25N3O2/c1-14-4-7-20-19(10-14)22-8-5-15(6-9-22)21-16-11-17(23-2)13-18(12-16)24-3/h4,7,10-13,15,21H,5-6,8-9H2,1-3H3
InChIKeyGLILFGYNAOMCBX-UHFFFAOYSA-N
XLogP3.49
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine?
The IUPAC name of N-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine (CID 122144100) is N-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine.
What is the SMILES notation for N-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine?
The canonical SMILES for N-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine is COc1cc(NC2CCN(c3cc(C)ccn3)CC2)cc(OC)c1.
What is the InChIKey of N-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine?
The InChIKey is GLILFGYNAOMCBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-14-4-7-20-19(10-14)22-8-5-15(6-9-22)21-16-11-17(23-2)13-18(12-16)24-3/h4,7,10-13,15,21H,5-6,8-9H2,1-3H3.
What are the key properties of N-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine?
N-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine has a molecular weight of 327.43 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethoxyphenyl)-1-(4-methyl-2-pyridinyl)piperidin-4-amine is sourced from PubChem (CID 122144100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).