[3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine

C14H29N3O — CID 113365446

IUPAC[3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine
SMILESCC1CC(C)C(CN)N(CCN2CCOCC2)C1
InChIInChI=1S/C14H29N3O/c1-12-9-13(2)14(10-15)17(11-12)4-3-16-5-7-18-8-6-16/h12-14H,3-11,15H2,1-2H3
InChIKeyKDNDHNRJJJSGRB-UHFFFAOYSA-N
MW255.41 g/mol
LogP0.62
Rot. Bonds4

About [3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine

[3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine (PubChem CID 113365446) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is [3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine.

Molecular Properties

Compound Name[3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine
PubChem CID113365446
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name[3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine
SMILESCC1CC(C)C(CN)N(CCN2CCOCC2)C1
InChIInChI=1S/C14H29N3O/c1-12-9-13(2)14(10-15)17(11-12)4-3-16-5-7-18-8-6-16/h12-14H,3-11,15H2,1-2H3
InChIKeyKDNDHNRJJJSGRB-UHFFFAOYSA-N
XLogP0.62
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine?
The IUPAC name of [3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine (CID 113365446) is [3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine.
What is the SMILES notation for [3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine?
The canonical SMILES for [3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine is CC1CC(C)C(CN)N(CCN2CCOCC2)C1.
What is the InChIKey of [3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine?
The InChIKey is KDNDHNRJJJSGRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-12-9-13(2)14(10-15)17(11-12)4-3-16-5-7-18-8-6-16/h12-14H,3-11,15H2,1-2H3.
What are the key properties of [3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine?
[3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine has a molecular weight of 255.41 g/mol, XLogP of 0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3,5-dimethyl-1-(2-morpholin-4-ylethyl)piperidin-2-yl]methanamine is sourced from PubChem (CID 113365446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).