2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine

C16H27N3O — CID 105074819

IUPAC2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine
SMILESCC(C)CNCc1ccncc1OC1CCN(C)CC1
InChIInChI=1S/C16H27N3O/c1-13(2)10-18-11-14-4-7-17-12-16(14)20-15-5-8-19(3)9-6-15/h4,7,12-13,15,18H,5-6,8-11H2,1-3H3
InChIKeyZIPBKLISFSUOKP-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.30
Rot. Bonds6

About 2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine

2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine (PubChem CID 105074819) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is 2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine
PubChem CID105074819
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC Name2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine
SMILESCC(C)CNCc1ccncc1OC1CCN(C)CC1
InChIInChI=1S/C16H27N3O/c1-13(2)10-18-11-14-4-7-17-12-16(14)20-15-5-8-19(3)9-6-15/h4,7,12-13,15,18H,5-6,8-11H2,1-3H3
InChIKeyZIPBKLISFSUOKP-UHFFFAOYSA-N
XLogP2.30
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine with MolForge

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Related Compounds

2-methyl-N-[[3-(2,2,3,3-tetrafluoropropoxy)-4-pyridinyl]methyl]propan-1-amine
CID 105075000
3-(1-methylpiperidin-4-yl)oxypyridine-4-carbonitrile
CID 114287934
N-[[3-(azocan-1-yl)-4-pyridinyl]methyl]-2-methylpropan-1-amine
CID 105072821
N-[(2-cyclobutyloxy-3-fluoro-4-pyridinyl)methyl]-2-methylpropan-1-amine
CID 105390709
N-[[3-[3-(methoxymethyl)pyrrolidin-1-yl]-4-pyridinyl]methyl]-2-methylpropan-1-amine
CID 105074060
8-(1-methylpiperidin-4-yl)oxyisoquinolin-5-amine
CID 103139941
N-[[3-(3,4-dimethoxypyrrolidin-1-yl)-4-pyridinyl]methyl]-2-methylpropan-1-amine
CID 103539529
N-[[4-(2-ethylcyclohexyl)oxy-3-pyridinyl]methyl]-2-methylpropan-1-amine
CID 81254183
N-[[3-(3,3,5-trimethylcyclohexyl)oxy-4-pyridinyl]methyl]ethanamine
CID 105075023
4-(difluoromethyl)-3-(1-methylpyrrolidin-3-yl)oxypyridine
CID 145415333
N-[[3-(3-ethylcyclohexyl)oxy-4-pyridinyl]methyl]propan-1-amine
CID 105075716
N-[[3-(3-bromophenoxy)-4-pyridinyl]methyl]-2-methylpropan-1-amine
CID 105075392

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine (CID 105074819) is 2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine is CC(C)CNCc1ccncc1OC1CCN(C)CC1.
What is the InChIKey of 2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine?
The InChIKey is ZIPBKLISFSUOKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-13(2)10-18-11-14-4-7-17-12-16(14)20-15-5-8-19(3)9-6-15/h4,7,12-13,15,18H,5-6,8-11H2,1-3H3.
What are the key properties of 2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine?
2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine has a molecular weight of 277.41 g/mol, XLogP of 2.30, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[3-(1-methylpiperidin-4-yl)oxy-4-pyridinyl]methyl]propan-1-amine is sourced from PubChem (CID 105074819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).