2-amino-1-(dipropylsulfamoylamino)-4-methylpentane

C12H29N3O2S — CID 43606375

IUPAC2-amino-1-(dipropylsulfamoylamino)-4-methylpentane
SMILESCCCN(CCC)S(=O)(=O)NCC(N)CC(C)C
InChIInChI=1S/C12H29N3O2S/c1-5-7-15(8-6-2)18(16,17)14-10-12(13)9-11(3)4/h11-12,14H,5-10,13H2,1-4H3
InChIKeyGGGZPMFVDJBQFA-UHFFFAOYSA-N
MW279.45 g/mol
LogP1.32
Rot. Bonds10

About 2-amino-1-(dipropylsulfamoylamino)-4-methylpentane

2-amino-1-(dipropylsulfamoylamino)-4-methylpentane (PubChem CID 43606375) has the molecular formula C12H29N3O2S and a molecular weight of 279.45 g/mol. Its IUPAC name is 2-amino-1-(dipropylsulfamoylamino)-4-methylpentane.

Molecular Properties

Compound Name2-amino-1-(dipropylsulfamoylamino)-4-methylpentane
PubChem CID43606375
Molecular FormulaC12H29N3O2S
Molecular Weight279.45 g/mol
Exact Mass279.20
IUPAC Name2-amino-1-(dipropylsulfamoylamino)-4-methylpentane
SMILESCCCN(CCC)S(=O)(=O)NCC(N)CC(C)C
InChIInChI=1S/C12H29N3O2S/c1-5-7-15(8-6-2)18(16,17)14-10-12(13)9-11(3)4/h11-12,14H,5-10,13H2,1-4H3
InChIKeyGGGZPMFVDJBQFA-UHFFFAOYSA-N
XLogP1.32
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.45
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(dipropylsulfamoylamino)-4-methylpentane?
The IUPAC name of 2-amino-1-(dipropylsulfamoylamino)-4-methylpentane (CID 43606375) is 2-amino-1-(dipropylsulfamoylamino)-4-methylpentane.
What is the SMILES notation for 2-amino-1-(dipropylsulfamoylamino)-4-methylpentane?
The canonical SMILES for 2-amino-1-(dipropylsulfamoylamino)-4-methylpentane is CCCN(CCC)S(=O)(=O)NCC(N)CC(C)C.
What is the InChIKey of 2-amino-1-(dipropylsulfamoylamino)-4-methylpentane?
The InChIKey is GGGZPMFVDJBQFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H29N3O2S/c1-5-7-15(8-6-2)18(16,17)14-10-12(13)9-11(3)4/h11-12,14H,5-10,13H2,1-4H3.
What are the key properties of 2-amino-1-(dipropylsulfamoylamino)-4-methylpentane?
2-amino-1-(dipropylsulfamoylamino)-4-methylpentane has a molecular weight of 279.45 g/mol, XLogP of 1.32, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(dipropylsulfamoylamino)-4-methylpentane is sourced from PubChem (CID 43606375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).