2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide

C10H22N2O3S — CID 119325448

IUPAC2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide
SMILESCCCC(N)C(=O)NC(C)CS(=O)(=O)CC
InChIInChI=1S/C10H22N2O3S/c1-4-6-9(11)10(13)12-8(3)7-16(14,15)5-2/h8-9H,4-7,11H2,1-3H3,(H,12,13)
InChIKeyRYDSNRZFKSAHNF-UHFFFAOYSA-N
MW250.36 g/mol
LogP0.05
Rot. Bonds7

About 2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide

2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide (PubChem CID 119325448) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is 2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide.

Molecular Properties

Compound Name2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide
PubChem CID119325448
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC Name2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide
SMILESCCCC(N)C(=O)NC(C)CS(=O)(=O)CC
InChIInChI=1S/C10H22N2O3S/c1-4-6-9(11)10(13)12-8(3)7-16(14,15)5-2/h8-9H,4-7,11H2,1-3H3,(H,12,13)
InChIKeyRYDSNRZFKSAHNF-UHFFFAOYSA-N
XLogP0.05
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-propan-2-ylsulfonylpentanamide
CID 86093557
2-amino-N-pent-4-en-2-ylpentanamide
CID 115734589
(2R)-2-amino-N-[1-(diethylamino)propan-2-yl]pentanamide
CID 103814036
2-amino-N-(3-methylbutan-2-yl)pentanamide
CID 43650228
(2R)-2-amino-N-[1-(methylamino)-1-oxopropan-2-yl]pentanamide
CID 103795688
(2S)-2-amino-N-hexan-3-ylpentanamide
CID 107569552
2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide
CID 79249157
2-amino-N-octan-2-ylbutanamide
CID 43711439
(2R)-2-amino-N-octan-4-ylpentanamide
CID 103797903
diethyl 2-(2-aminopentanoylamino)propanedioate
CID 119275264
(2S)-2-amino-N-hexan-2-ylbutanamide
CID 79023466
(2S)-2-amino-N-(1-morpholin-4-ylpropan-2-yl)pentanamide
CID 107568380

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide?
The IUPAC name of 2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide (CID 119325448) is 2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide.
What is the SMILES notation for 2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide?
The canonical SMILES for 2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide is CCCC(N)C(=O)NC(C)CS(=O)(=O)CC.
What is the InChIKey of 2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide?
The InChIKey is RYDSNRZFKSAHNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-4-6-9(11)10(13)12-8(3)7-16(14,15)5-2/h8-9H,4-7,11H2,1-3H3,(H,12,13).
What are the key properties of 2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide?
2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide has a molecular weight of 250.36 g/mol, XLogP of 0.05, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-ethylsulfonylpropan-2-yl)pentanamide is sourced from PubChem (CID 119325448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).