N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine

C16H27N3 — CID 103496916

IUPACN-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine
SMILESCNC(C)c1ccnc(N2CCC(C(C)C)CC2)c1
InChIInChI=1S/C16H27N3/c1-12(2)14-6-9-19(10-7-14)16-11-15(5-8-18-16)13(3)17-4/h5,8,11-14,17H,6-7,9-10H2,1-4H3
InChIKeyZSSYLDZFITXMIG-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.23
Rot. Bonds4

About N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine

N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine (PubChem CID 103496916) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine
PubChem CID103496916
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC NameN-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine
SMILESCNC(C)c1ccnc(N2CCC(C(C)C)CC2)c1
InChIInChI=1S/C16H27N3/c1-12(2)14-6-9-19(10-7-14)16-11-15(5-8-18-16)13(3)17-4/h5,8,11-14,17H,6-7,9-10H2,1-4H3
InChIKeyZSSYLDZFITXMIG-UHFFFAOYSA-N
XLogP3.23
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(azetidin-1-yl)-4-pyridinyl]-N-methylethanamine
CID 130547348
[1-[4-[1-(methylamino)ethyl]-2-pyridinyl]pyrrolidin-3-yl]methanol
CID 112626014
N-methyl-1-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]ethanamine
CID 63853355
N-methyl-1-[2-(5-methyl-3,6-dihydro-2H-pyridin-1-yl)-4-pyridinyl]ethanamine
CID 114172403
N-methyl-1-[2-(2,2,6,6-tetramethylmorpholin-4-yl)-4-pyridinyl]ethanamine
CID 102744238
2-[4-[1-(methylamino)ethyl]-2-pyridinyl]-1,3,4,5,6,7,8,8a-octahydroisoquinolin-4a-ol
CID 81096167
1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-3-methylpiperidin-4-ol
CID 114678935
1-[4-[1-(ethylamino)ethyl]-2-pyridinyl]-4-methylpiperidin-3-ol
CID 102958933
4-ethyl-2-(3-propan-2-ylpyrrolidin-1-yl)pyridine
CID 170397345
[4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine
CID 103504775
2-[4-(difluoromethyl)piperidin-1-yl]-4-methylpyridine
CID 171993927
N-ethyl-1-[2-(3-methoxypiperidin-1-yl)-4-pyridinyl]ethanamine
CID 102959126

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine?
The IUPAC name of N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine (CID 103496916) is N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine.
What is the SMILES notation for N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine?
The canonical SMILES for N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine is CNC(C)c1ccnc(N2CCC(C(C)C)CC2)c1.
What is the InChIKey of N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine?
The InChIKey is ZSSYLDZFITXMIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-12(2)14-6-9-19(10-7-14)16-11-15(5-8-18-16)13(3)17-4/h5,8,11-14,17H,6-7,9-10H2,1-4H3.
What are the key properties of N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine?
N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine has a molecular weight of 261.41 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)-4-pyridinyl]ethanamine is sourced from PubChem (CID 103496916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).