N-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine

C16H27N3O — CID 62416078

IUPACN-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine
SMILESCC(C)Oc1ncccc1NCCC1CCCCN1C
InChIInChI=1S/C16H27N3O/c1-13(2)20-16-15(8-6-10-18-16)17-11-9-14-7-4-5-12-19(14)3/h6,8,10,13-14,17H,4-5,7,9,11-12H2,1-3H3
InChIKeyFZVVWCPOXJCBIE-UHFFFAOYSA-N
MW277.41 g/mol
LogP3.16
Rot. Bonds6

About N-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine

N-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine (PubChem CID 62416078) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is N-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine.

Molecular Properties

Compound NameN-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine
PubChem CID62416078
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC NameN-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine
SMILESCC(C)Oc1ncccc1NCCC1CCCCN1C
InChIInChI=1S/C16H27N3O/c1-13(2)20-16-15(8-6-10-18-16)17-11-9-14-7-4-5-12-19(14)3/h6,8,10,13-14,17H,4-5,7,9,11-12H2,1-3H3
InChIKeyFZVVWCPOXJCBIE-UHFFFAOYSA-N
XLogP3.16
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 ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(1-methylpyrrolidin-2-yl)ethyl]pyridin-2-amine
CID 141285669
N-(4-methoxybutyl)-2-propan-2-yloxypyridin-3-amine
CID 113436858
N-ethyl-2-propan-2-yloxypyridin-3-amine
CID 61374229
N-[2-(2-methylpyrazol-3-yl)ethyl]-2-propan-2-yloxypyridin-3-amine
CID 103001068
2-methyl-4-[(2-propan-2-yloxy-3-pyridinyl)amino]butan-2-ol
CID 79359765
N-(2-ethylsulfonylethyl)-2-propan-2-yloxypyridin-3-amine
CID 61379623
N-(2-methylcyclohexyl)-2-propan-2-yloxypyridin-3-amine
CID 63455454
N-(2-tert-butylcyclohexyl)-2-propan-2-yloxypyridin-3-amine
CID 63455455
N-(3-phenylbutyl)-2-propan-2-yloxypyridin-3-amine
CID 63456333
N-(1-cyclobutylpropan-2-yl)-2-propan-2-yloxypyridin-3-amine
CID 113489848
N-[(1-methylpyrazol-4-yl)methyl]-2-propan-2-yloxypyridin-3-amine
CID 61375775
1-ethyl-N-(2-propan-2-yloxy-3-pyridinyl)azepan-4-amine
CID 65073239

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine?
The IUPAC name of N-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine (CID 62416078) is N-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine.
What is the SMILES notation for N-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine?
The canonical SMILES for N-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine is CC(C)Oc1ncccc1NCCC1CCCCN1C.
What is the InChIKey of N-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine?
The InChIKey is FZVVWCPOXJCBIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-13(2)20-16-15(8-6-10-18-16)17-11-9-14-7-4-5-12-19(14)3/h6,8,10,13-14,17H,4-5,7,9,11-12H2,1-3H3.
What are the key properties of N-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine?
N-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine has a molecular weight of 277.41 g/mol, XLogP of 3.16, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylpiperidin-2-yl)ethyl]-2-propan-2-yloxypyridin-3-amine is sourced from PubChem (CID 62416078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).