[4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine

C15H25N3 — CID 63888263

IUPAC[4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
SMILESCCC1(C)CCN(Cc2ccnc(CN)c2)CC1
InChIInChI=1S/C15H25N3/c1-3-15(2)5-8-18(9-6-15)12-13-4-7-17-14(10-13)11-16/h4,7,10H,3,5-6,8-9,11-12,16H2,1-2H3
InChIKeyUAZZWYVROCCQIV-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.55
Rot. Bonds4

About [4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine

[4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine (PubChem CID 63888263) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is [4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
PubChem CID63888263
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name[4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine
SMILESCCC1(C)CCN(Cc2ccnc(CN)c2)CC1
InChIInChI=1S/C15H25N3/c1-3-15(2)5-8-18(9-6-15)12-13-4-7-17-14(10-13)11-16/h4,7,10H,3,5-6,8-9,11-12,16H2,1-2H3
InChIKeyUAZZWYVROCCQIV-UHFFFAOYSA-N
XLogP2.55
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
The IUPAC name of [4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine (CID 63888263) is [4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine.
What is the SMILES notation for [4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
The canonical SMILES for [4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine is CCC1(C)CCN(Cc2ccnc(CN)c2)CC1.
What is the InChIKey of [4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
The InChIKey is UAZZWYVROCCQIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-3-15(2)5-8-18(9-6-15)12-13-4-7-17-14(10-13)11-16/h4,7,10H,3,5-6,8-9,11-12,16H2,1-2H3.
What are the key properties of [4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine?
[4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine has a molecular weight of 247.39 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-2-pyridinyl]methanamine is sourced from PubChem (CID 63888263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).