1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine

C12H25N3O3S — CID 54923533

IUPAC1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(S(=O)(=O)N2CCOCC2)CC1
InChIInChI=1S/C12H25N3O3S/c1-2-5-13-12-3-6-14(7-4-12)19(16,17)15-8-10-18-11-9-15/h12-13H,2-11H2,1H3
InChIKeyMZISCARMMYYEPW-UHFFFAOYSA-N
MW291.42 g/mol
LogP0.03
Rot. Bonds5

About 1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine

1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine (PubChem CID 54923533) has the molecular formula C12H25N3O3S and a molecular weight of 291.42 g/mol. Its IUPAC name is 1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine
PubChem CID54923533
Molecular FormulaC12H25N3O3S
Molecular Weight291.42 g/mol
Exact Mass291.16
IUPAC Name1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(S(=O)(=O)N2CCOCC2)CC1
InChIInChI=1S/C12H25N3O3S/c1-2-5-13-12-3-6-14(7-4-12)19(16,17)15-8-10-18-11-9-15/h12-13H,2-11H2,1H3
InChIKeyMZISCARMMYYEPW-UHFFFAOYSA-N
XLogP0.03
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine?
The IUPAC name of 1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine (CID 54923533) is 1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine.
What is the SMILES notation for 1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine?
The canonical SMILES for 1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine is CCCNC1CCN(S(=O)(=O)N2CCOCC2)CC1.
What is the InChIKey of 1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine?
The InChIKey is MZISCARMMYYEPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O3S/c1-2-5-13-12-3-6-14(7-4-12)19(16,17)15-8-10-18-11-9-15/h12-13H,2-11H2,1H3.
What are the key properties of 1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine?
1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine has a molecular weight of 291.42 g/mol, XLogP of 0.03, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-ylsulfonyl-N-propylpiperidin-4-amine is sourced from PubChem (CID 54923533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).