N-(2-hydroxyhexan-3-yl)propanamide

C9H19NO2 — CID 163591274

IUPACN-(2-hydroxyhexan-3-yl)propanamide
SMILESCCCC(NC(=O)CC)C(C)O
InChIInChI=1S/C9H19NO2/c1-4-6-8(7(3)11)10-9(12)5-2/h7-8,11H,4-6H2,1-3H3,(H,10,12)
InChIKeyGPSOMBUSFGBWEF-UHFFFAOYSA-N
MW173.26 g/mol
LogP1.06
Rot. Bonds5

About N-(2-hydroxyhexan-3-yl)propanamide

N-(2-hydroxyhexan-3-yl)propanamide (PubChem CID 163591274) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is N-(2-hydroxyhexan-3-yl)propanamide.

Molecular Properties

Compound NameN-(2-hydroxyhexan-3-yl)propanamide
PubChem CID163591274
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC NameN-(2-hydroxyhexan-3-yl)propanamide
SMILESCCCC(NC(=O)CC)C(C)O
InChIInChI=1S/C9H19NO2/c1-4-6-8(7(3)11)10-9(12)5-2/h7-8,11H,4-6H2,1-3H3,(H,10,12)
InChIKeyGPSOMBUSFGBWEF-UHFFFAOYSA-N
XLogP1.06
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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N-(1-iodo-3-methylbutan-2-yl)propanamide
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N-propan-2-ylpropanamide;dihydrochloride
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N-(1-methoxy-4-methylpentan-3-yl)propanamide
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[(4R,5S)-5-(carbamoylamino)octan-4-yl]urea
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N-dodecan-2-ylpropanamide
CID 174988669
4,5-dimethyl-3-(propanoylamino)nonanoic acid
CID 11379869
N-(1-sulfanylethyl)propanamide
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N-hex-1-en-3-ylpropanamide
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3-hydroxy-2-(propanoylamino)-N-propan-2-ylbutanamide
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(6S)-4,6-dimethylnonan-5-one
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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyhexan-3-yl)propanamide?
The IUPAC name of N-(2-hydroxyhexan-3-yl)propanamide (CID 163591274) is N-(2-hydroxyhexan-3-yl)propanamide.
What is the SMILES notation for N-(2-hydroxyhexan-3-yl)propanamide?
The canonical SMILES for N-(2-hydroxyhexan-3-yl)propanamide is CCCC(NC(=O)CC)C(C)O.
What is the InChIKey of N-(2-hydroxyhexan-3-yl)propanamide?
The InChIKey is GPSOMBUSFGBWEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-4-6-8(7(3)11)10-9(12)5-2/h7-8,11H,4-6H2,1-3H3,(H,10,12).
What are the key properties of N-(2-hydroxyhexan-3-yl)propanamide?
N-(2-hydroxyhexan-3-yl)propanamide has a molecular weight of 173.26 g/mol, XLogP of 1.06, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyhexan-3-yl)propanamide is sourced from PubChem (CID 163591274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).