(3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine

C19H26N4O — CID 124742358

IUPAC(3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine
SMILESCOc1ccc(CN[C@@H]2CCN(Cc3ccccn3)C[C@H]2C)cn1
InChIInChI=1S/C19H26N4O/c1-15-13-23(14-17-5-3-4-9-20-17)10-8-18(15)21-11-16-6-7-19(24-2)22-12-16/h3-7,9,12,15,18,21H,8,10-11,13-14H2,1-2H3/t15-,18-/m1/s1
InChIKeyXUBRDCDNFICJKW-CRAIPNDOSA-N
MW326.44 g/mol
LogP2.49
Rot. Bonds6

About (3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine

(3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine (PubChem CID 124742358) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is (3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine.

Molecular Properties

Compound Name(3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine
PubChem CID124742358
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC Name(3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine
SMILESCOc1ccc(CN[C@@H]2CCN(Cc3ccccn3)C[C@H]2C)cn1
InChIInChI=1S/C19H26N4O/c1-15-13-23(14-17-5-3-4-9-20-17)10-8-18(15)21-11-16-6-7-19(24-2)22-12-16/h3-7,9,12,15,18,21H,8,10-11,13-14H2,1-2H3/t15-,18-/m1/s1
InChIKeyXUBRDCDNFICJKW-CRAIPNDOSA-N
XLogP2.49
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine with MolForge

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Launch Full Analysis

Related Compounds

1-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-N-propylpiperidin-4-amine
CID 62992462
N-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine
CID 86818582
[(3R,4S)-1-benzyl-3-[(6-methoxy-3-pyridinyl)methylamino]piperidin-4-yl]methanol
CID 97307269
N-[(6-methoxy-3-pyridinyl)methyl]-2-methylcyclopropan-1-amine
CID 114936732
N-[(6-methoxy-3-pyridinyl)methyl]-1-azabicyclo[3.2.1]octan-4-amine
CID 105363784
methyl 1-[[[3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]methyl]cyclohexane-1-carboxylate
CID 91653500
6-ethoxy-N-[(3R,4S)-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrimidin-4-amine
CID 124735936
methyl 4-[[(3R,4R)-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]piperidine-1-carboxylate
CID 124732005
2-[(1S)-1-[[(3S,4R)-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]propyl]phenol
CID 99701828
1-[(3S,4S)-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-yl]-3-phenylurea
CID 95629029
2-[(1S)-1-[[(3S,4S)-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]propyl]phenol
CID 99701830
2-[[(3S,4S)-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-yl]amino]pyridine-3-carbonitrile
CID 95980423

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine?
The IUPAC name of (3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine (CID 124742358) is (3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine.
What is the SMILES notation for (3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine?
The canonical SMILES for (3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine is COc1ccc(CN[C@@H]2CCN(Cc3ccccn3)C[C@H]2C)cn1.
What is the InChIKey of (3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine?
The InChIKey is XUBRDCDNFICJKW-CRAIPNDOSA-N. The full InChI is InChI=1S/C19H26N4O/c1-15-13-23(14-17-5-3-4-9-20-17)10-8-18(15)21-11-16-6-7-19(24-2)22-12-16/h3-7,9,12,15,18,21H,8,10-11,13-14H2,1-2H3/t15-,18-/m1/s1.
What are the key properties of (3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine?
(3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine has a molecular weight of 326.44 g/mol, XLogP of 2.49, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-N-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-amine is sourced from PubChem (CID 124742358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).