(2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol

C19H33N3O2 — CID 95757646

IUPAC(2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol
SMILESCOc1c(C)cnc(CN(C)CC2CCN(C[C@@H](C)O)CC2)c1C
InChIInChI=1S/C19H33N3O2/c1-14-10-20-18(16(3)19(14)24-5)13-21(4)12-17-6-8-22(9-7-17)11-15(2)23/h10,15,17,23H,6-9,11-13H2,1-5H3/t15-/m1/s1
InChIKeySLBFYSGSYQSJAE-OAHLLOKOSA-N
MW335.49 g/mol
LogP2.23
Rot. Bonds7

About (2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol

(2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol (PubChem CID 95757646) has the molecular formula C19H33N3O2 and a molecular weight of 335.49 g/mol. Its IUPAC name is (2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol.

Molecular Properties

Compound Name(2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol
PubChem CID95757646
Molecular FormulaC19H33N3O2
Molecular Weight335.49 g/mol
Exact Mass335.26
IUPAC Name(2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol
SMILESCOc1c(C)cnc(CN(C)CC2CCN(C[C@@H](C)O)CC2)c1C
InChIInChI=1S/C19H33N3O2/c1-14-10-20-18(16(3)19(14)24-5)13-21(4)12-17-6-8-22(9-7-17)11-15(2)23/h10,15,17,23H,6-9,11-13H2,1-5H3/t15-/m1/s1
InChIKeySLBFYSGSYQSJAE-OAHLLOKOSA-N
XLogP2.23
TPSA48.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.49
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol 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-Dimethyl-2-hydroxymethyl-4-methoxy-pyridine
CID 737823
4-Methoxy-2,3,5-trimethylpyridine
CID 127899
(4-Methoxy-3,5-dimethylpyridin-2-yl)methanamine
CID 14645997
2-[[1-[(4-Methoxy-3,5-dimethyl-2-pyridinyl)methyl]piperidin-4-yl]-methylamino]propanamide
CID 53557730
[(4-Methoxy-3,5-dimethylpyridin-2-yl)methyl](methyl)amine
CID 28399741
N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylcyclohexanamine
CID 47090457
4-Methoxy-N,N,3,5-tetramethyl-2-pyridinemethanamine
CID 25313156
2-(Azidomethyl)-4-methoxy-3,5-dimethylpyridine
CID 25219407
N-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]propan-1-amine
CID 16459993
N-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]-2-methylpropan-1-amine
CID 25219416
2-methoxy-N-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]piperidin-4-yl]-N-methylpropanamide
CID 53563136
N-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]piperidin-4-yl]-N-methylmethanesulfonamide
CID 53563668

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol?
The IUPAC name of (2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol (CID 95757646) is (2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol.
What is the SMILES notation for (2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol?
The canonical SMILES for (2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol is COc1c(C)cnc(CN(C)CC2CCN(C[C@@H](C)O)CC2)c1C.
What is the InChIKey of (2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol?
The InChIKey is SLBFYSGSYQSJAE-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H33N3O2/c1-14-10-20-18(16(3)19(14)24-5)13-21(4)12-17-6-8-22(9-7-17)11-15(2)23/h10,15,17,23H,6-9,11-13H2,1-5H3/t15-/m1/s1.
What are the key properties of (2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol?
(2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol has a molecular weight of 335.49 g/mol, XLogP of 2.23, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[4-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl-methylamino]methyl]piperidin-1-yl]propan-2-ol is sourced from PubChem (CID 95757646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).