N-(2-amino-3-hydroxybutyl)-2-ethylbutanamide

C10H22N2O2 — CID 64541693

IUPACN-(2-amino-3-hydroxybutyl)-2-ethylbutanamide
SMILESCCC(CC)C(=O)NCC(N)C(C)O
InChIInChI=1S/C10H22N2O2/c1-4-8(5-2)10(14)12-6-9(11)7(3)13/h7-9,13H,4-6,11H2,1-3H3,(H,12,14)
InChIKeySQUXGAPSVOABLV-UHFFFAOYSA-N
MW202.30 g/mol
LogP0.25
Rot. Bonds6

About N-(2-amino-3-hydroxybutyl)-2-ethylbutanamide

N-(2-amino-3-hydroxybutyl)-2-ethylbutanamide (PubChem CID 64541693) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is N-(2-amino-3-hydroxybutyl)-2-ethylbutanamide.

Molecular Properties

Compound NameN-(2-amino-3-hydroxybutyl)-2-ethylbutanamide
PubChem CID64541693
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC NameN-(2-amino-3-hydroxybutyl)-2-ethylbutanamide
SMILESCCC(CC)C(=O)NCC(N)C(C)O
InChIInChI=1S/C10H22N2O2/c1-4-8(5-2)10(14)12-6-9(11)7(3)13/h7-9,13H,4-6,11H2,1-3H3,(H,12,14)
InChIKeySQUXGAPSVOABLV-UHFFFAOYSA-N
XLogP0.25
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminopropyl)-2-ethylbutanamide
CID 63732725
2-ethyl-N-[(2R)-2-hydroxypropyl]butanamide
CID 39236453
1-(2-amino-3-hydroxybutyl)-3-ethylurea
CID 64541484
N-(2-amino-3-hydroxybutyl)-3-methylpentanamide
CID 114875635
N-(2-amino-3-hydroxybutyl)-2-cyclopropylpropanamide
CID 83148940
N-(2-aminopentyl)-2-ethylbutanamide
CID 115737781
2-[[[(2R)-2-aminopropanoyl]amino]methyl]butanoic acid
CID 65224335
N-[2-(diethylamino)propyl]-2-ethylbutanamide
CID 78883396
2-ethyl-N-[2-(2-hydroxypropylamino)ethyl]butanamide
CID 104593762
2-(aminomethyl)-N-(2-methylbutyl)butanamide
CID 62691581
(2S)-2-amino-N-(2-hydroxybutyl)propanamide
CID 104866791
N-(2-cyclopropyl-2-hydroxyethyl)-2-ethylbutanamide
CID 63294520

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-3-hydroxybutyl)-2-ethylbutanamide?
The IUPAC name of N-(2-amino-3-hydroxybutyl)-2-ethylbutanamide (CID 64541693) is N-(2-amino-3-hydroxybutyl)-2-ethylbutanamide.
What is the SMILES notation for N-(2-amino-3-hydroxybutyl)-2-ethylbutanamide?
The canonical SMILES for N-(2-amino-3-hydroxybutyl)-2-ethylbutanamide is CCC(CC)C(=O)NCC(N)C(C)O.
What is the InChIKey of N-(2-amino-3-hydroxybutyl)-2-ethylbutanamide?
The InChIKey is SQUXGAPSVOABLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-4-8(5-2)10(14)12-6-9(11)7(3)13/h7-9,13H,4-6,11H2,1-3H3,(H,12,14).
What are the key properties of N-(2-amino-3-hydroxybutyl)-2-ethylbutanamide?
N-(2-amino-3-hydroxybutyl)-2-ethylbutanamide has a molecular weight of 202.30 g/mol, XLogP of 0.25, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-3-hydroxybutyl)-2-ethylbutanamide is sourced from PubChem (CID 64541693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).