4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine

C8H19N3O2S — CID 114812950

IUPAC4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine
SMILESCC(N)CC(C)NS(=O)(=O)NC1CC1
InChIInChI=1S/C8H19N3O2S/c1-6(9)5-7(2)10-14(12,13)11-8-3-4-8/h6-8,10-11H,3-5,9H2,1-2H3
InChIKeyFMKFCBSYJUJTLB-UHFFFAOYSA-N
MW221.33 g/mol
LogP-0.30
Rot. Bonds6

About 4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine

4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine (PubChem CID 114812950) has the molecular formula C8H19N3O2S and a molecular weight of 221.33 g/mol. Its IUPAC name is 4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine.

Molecular Properties

Compound Name4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine
PubChem CID114812950
Molecular FormulaC8H19N3O2S
Molecular Weight221.33 g/mol
Exact Mass221.12
IUPAC Name4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine
SMILESCC(N)CC(C)NS(=O)(=O)NC1CC1
InChIInChI=1S/C8H19N3O2S/c1-6(9)5-7(2)10-14(12,13)11-8-3-4-8/h6-8,10-11H,3-5,9H2,1-2H3
InChIKeyFMKFCBSYJUJTLB-UHFFFAOYSA-N
XLogP-0.30
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.33
LogP ≤ 5-0.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(butan-2-ylsulfamoyl)cyclopropanamine
CID 114383068
1-N-(cyclopropylsulfamoyl)-3-methylbutane-1,2-diamine
CID 114810889
1-N-(cyclopropylsulfamoyl)-2-N-methylpropane-1,2-diamine
CID 103512559
2-(cyclopropylsulfamoylamino)propanoic acid
CID 114805252
3-(cyclopropylsulfamoylamino)butan-2-one
CID 114808600
4-(propan-2-ylsulfamoylamino)cyclohexan-1-ol
CID 103946865
2-(cyclopropylsulfamoylamino)pentan-3-one
CID 114808587
3-N-(cyclopropylsulfamoyl)-4-methoxybutane-1,3-diamine
CID 106153953
1-N-methyl-4-N-(2-methylpropylsulfamoyl)cyclohexane-1,4-diamine
CID 114814968
(2R)-5-amino-2-(cyclopropylsulfamoylamino)-5-oxopentanoic acid
CID 104935540
N-(hydrazinesulfonyl)cyclopropanamine
CID 114807411
2-(cyclopropylsulfamoylamino)-4-methoxybutanoic acid
CID 114533415

Frequently Asked Questions

What is the IUPAC name of 4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine?
The IUPAC name of 4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine (CID 114812950) is 4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine.
What is the SMILES notation for 4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine?
The canonical SMILES for 4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine is CC(N)CC(C)NS(=O)(=O)NC1CC1.
What is the InChIKey of 4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine?
The InChIKey is FMKFCBSYJUJTLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O2S/c1-6(9)5-7(2)10-14(12,13)11-8-3-4-8/h6-8,10-11H,3-5,9H2,1-2H3.
What are the key properties of 4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine?
4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine has a molecular weight of 221.33 g/mol, XLogP of -0.30, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(cyclopropylsulfamoyl)pentane-2,4-diamine is sourced from PubChem (CID 114812950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).