N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine

C20H34N4O — CID 45250208

IUPACN-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine
SMILESCC(C)(CNC1CCCN(Cc2ccccn2)C1)CN1CCOCC1
InChIInChI=1S/C20H34N4O/c1-20(2,17-23-10-12-25-13-11-23)16-22-19-7-5-9-24(15-19)14-18-6-3-4-8-21-18/h3-4,6,8,19,22H,5,7,9-17H2,1-2H3
InChIKeyUFSLOEGXVQNYSM-UHFFFAOYSA-N
MW346.52 g/mol
LogP1.99
Rot. Bonds7

About N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine

N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine (PubChem CID 45250208) has the molecular formula C20H34N4O and a molecular weight of 346.52 g/mol. Its IUPAC name is N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine.

Molecular Properties

Compound NameN-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine
PubChem CID45250208
Molecular FormulaC20H34N4O
Molecular Weight346.52 g/mol
Exact Mass346.27
IUPAC NameN-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine
SMILESCC(C)(CNC1CCCN(Cc2ccccn2)C1)CN1CCOCC1
InChIInChI=1S/C20H34N4O/c1-20(2,17-23-10-12-25-13-11-23)16-22-19-7-5-9-24(15-19)14-18-6-3-4-8-21-18/h3-4,6,8,19,22H,5,7,9-17H2,1-2H3
InChIKeyUFSLOEGXVQNYSM-UHFFFAOYSA-N
XLogP1.99
TPSA40.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.52
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine?
The IUPAC name of N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine (CID 45250208) is N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine.
What is the SMILES notation for N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine?
The canonical SMILES for N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine is CC(C)(CNC1CCCN(Cc2ccccn2)C1)CN1CCOCC1.
What is the InChIKey of N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine?
The InChIKey is UFSLOEGXVQNYSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H34N4O/c1-20(2,17-23-10-12-25-13-11-23)16-22-19-7-5-9-24(15-19)14-18-6-3-4-8-21-18/h3-4,6,8,19,22H,5,7,9-17H2,1-2H3.
What are the key properties of N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine?
N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine has a molecular weight of 346.52 g/mol, XLogP of 1.99, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyl-3-morpholin-4-ylpropyl)-1-(pyridin-2-ylmethyl)piperidin-3-amine is sourced from PubChem (CID 45250208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).