6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide

C11H18N4O2S — CID 62321102

IUPAC6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide
SMILESNC1CCC(Nc2ccc(S(N)(=O)=O)cn2)CC1
InChIInChI=1S/C11H18N4O2S/c12-8-1-3-9(4-2-8)15-11-6-5-10(7-14-11)18(13,16)17/h5-9H,1-4,12H2,(H,14,15)(H2,13,16,17)
InChIKeyPGNBQPYKUFTPCB-UHFFFAOYSA-N
MW270.36 g/mol
LogP0.41
Rot. Bonds3

About 6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide

6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide (PubChem CID 62321102) has the molecular formula C11H18N4O2S and a molecular weight of 270.36 g/mol. Its IUPAC name is 6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide
PubChem CID62321102
Molecular FormulaC11H18N4O2S
Molecular Weight270.36 g/mol
Exact Mass270.12
IUPAC Name6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide
SMILESNC1CCC(Nc2ccc(S(N)(=O)=O)cn2)CC1
InChIInChI=1S/C11H18N4O2S/c12-8-1-3-9(4-2-8)15-11-6-5-10(7-14-11)18(13,16)17/h5-9H,1-4,12H2,(H,14,15)(H2,13,16,17)
InChIKeyPGNBQPYKUFTPCB-UHFFFAOYSA-N
XLogP0.41
TPSA111.10 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 50.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-6-(cyclopropylamino)pyridine-3-sulfonamide
CID 96664227
4-N-(5-nitro-2-pyridinyl)cyclohexane-1,4-diamine
CID 22591359
4-N-(5-fluoro-2-pyridinyl)cyclohexane-1,4-diamine
CID 62312959
6-[(4-aminocyclohexyl)amino]pyridine-3-carboxamide
CID 58337929
4-N-(5-methyl-2-pyridinyl)cyclohexane-1,4-diamine;dihydrochloride
CID 86694119
4-N-(5-tert-butyl-2-pyridinyl)cyclohexane-1,4-diamine
CID 114011527
N-tert-butyl-6-(cyclopropylamino)pyridine-3-sulfonamide
CID 98018239
6-[(4-hydroxycyclohexyl)amino]-N,N-dimethylpyridine-3-sulfonamide
CID 103623850
6-(oxan-4-ylmethylamino)pyridine-3-sulfonamide
CID 134319004
6-[[1-(3,5-dimethoxyphenyl)pyrrolidin-3-yl]amino]pyridine-3-sulfonamide
CID 154757700
2-N-cyclopropylpyridine-2,5-diamine
CID 16776026
6-[(5-amino-2,3-dihydro-1H-inden-1-yl)amino]pyridine-3-sulfonamide
CID 79722672

Frequently Asked Questions

What is the IUPAC name of 6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide?
The IUPAC name of 6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide (CID 62321102) is 6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide.
What is the SMILES notation for 6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide?
The canonical SMILES for 6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide is NC1CCC(Nc2ccc(S(N)(=O)=O)cn2)CC1.
What is the InChIKey of 6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide?
The InChIKey is PGNBQPYKUFTPCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2S/c12-8-1-3-9(4-2-8)15-11-6-5-10(7-14-11)18(13,16)17/h5-9H,1-4,12H2,(H,14,15)(H2,13,16,17).
What are the key properties of 6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide?
6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide has a molecular weight of 270.36 g/mol, XLogP of 0.41, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-aminocyclohexyl)amino]pyridine-3-sulfonamide is sourced from PubChem (CID 62321102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).