[4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid

C16H24N4O5S — CID 174214991

IUPAC[4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid
SMILESO=C(O)NC1CCC(NS(=O)(=O)c2ccc(N3CCOCC3)nc2)CC1
InChIInChI=1S/C16H24N4O5S/c21-16(22)18-12-1-3-13(4-2-12)19-26(23,24)14-5-6-15(17-11-14)20-7-9-25-10-8-20/h5-6,11-13,18-19H,1-4,7-10H2,(H,21,22)
InChIKeyBSLRWQRUHBNLNR-UHFFFAOYSA-N
MW384.46 g/mol
LogP0.78
Rot. Bonds5

About [4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid

[4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid (PubChem CID 174214991) has the molecular formula C16H24N4O5S and a molecular weight of 384.46 g/mol. Its IUPAC name is [4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid.

Molecular Properties

Compound Name[4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid
PubChem CID174214991
Molecular FormulaC16H24N4O5S
Molecular Weight384.46 g/mol
Exact Mass384.15
IUPAC Name[4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid
SMILESO=C(O)NC1CCC(NS(=O)(=O)c2ccc(N3CCOCC3)nc2)CC1
InChIInChI=1S/C16H24N4O5S/c21-16(22)18-12-1-3-13(4-2-12)19-26(23,24)14-5-6-15(17-11-14)20-7-9-25-10-8-20/h5-6,11-13,18-19H,1-4,7-10H2,(H,21,22)
InChIKeyBSLRWQRUHBNLNR-UHFFFAOYSA-N
XLogP0.78
TPSA120.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.46
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid?
The IUPAC name of [4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid (CID 174214991) is [4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid.
What is the SMILES notation for [4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid?
The canonical SMILES for [4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid is O=C(O)NC1CCC(NS(=O)(=O)c2ccc(N3CCOCC3)nc2)CC1.
What is the InChIKey of [4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid?
The InChIKey is BSLRWQRUHBNLNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O5S/c21-16(22)18-12-1-3-13(4-2-12)19-26(23,24)14-5-6-15(17-11-14)20-7-9-25-10-8-20/h5-6,11-13,18-19H,1-4,7-10H2,(H,21,22).
What are the key properties of [4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid?
[4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid has a molecular weight of 384.46 g/mol, XLogP of 0.78, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(6-morpholin-4-yl-3-pyridinyl)sulfonylamino]cyclohexyl]carbamic acid is sourced from PubChem (CID 174214991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).