2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide

C10H22N2O2 — CID 66092546

IUPAC2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide
SMILESCCCNC(=O)CNCC(C)CCO
InChIInChI=1S/C10H22N2O2/c1-3-5-12-10(14)8-11-7-9(2)4-6-13/h9,11,13H,3-8H2,1-2H3,(H,12,14)
InChIKeyUKDNCXKDLDYDRP-UHFFFAOYSA-N
MW202.30 g/mol
LogP0.12
Rot. Bonds8

About 2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide

2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide (PubChem CID 66092546) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide.

Molecular Properties

Compound Name2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide
PubChem CID66092546
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide
SMILESCCCNC(=O)CNCC(C)CCO
InChIInChI=1S/C10H22N2O2/c1-3-5-12-10(14)8-11-7-9(2)4-6-13/h9,11,13H,3-8H2,1-2H3,(H,12,14)
InChIKeyUKDNCXKDLDYDRP-UHFFFAOYSA-N
XLogP0.12
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[[(2S)-2-hydroxypropyl]amino]-N-propylacetamide
CID 106931868
2-[(4-hydroxy-2-methylbutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 66091400
2-(3-methylbutylamino)-N-propylacetamide
CID 28576469
N-ethyl-3-[(4-hydroxy-2-methylbutyl)amino]propanamide
CID 66091624
3-methyl-4-(2-methylpentylamino)butan-1-ol
CID 66092685
2-(5-methylhexylamino)-N-propylacetamide
CID 115325791
2-chloro-N-(4-hydroxy-2-methylbutyl)acetamide
CID 66089686
3-methyl-N-propylhexanamide
CID 143315126
(4R)-4-amino-N-propylpentanamide
CID 146234117
2-[2-[methyl(propan-2-yl)amino]ethylamino]-N-propylacetamide
CID 62642701
2-amino-N-(4-hydroxy-2-methylbutyl)acetamide
CID 66089038
heptane;N-(2-hydroxyethyl)-2-[[2-(2-hydroxyethylamino)-2-oxoethyl]amino]acetamide
CID 142436923

Frequently Asked Questions

What is the IUPAC name of 2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide?
The IUPAC name of 2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide (CID 66092546) is 2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide.
What is the SMILES notation for 2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide?
The canonical SMILES for 2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide is CCCNC(=O)CNCC(C)CCO.
What is the InChIKey of 2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide?
The InChIKey is UKDNCXKDLDYDRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-3-5-12-10(14)8-11-7-9(2)4-6-13/h9,11,13H,3-8H2,1-2H3,(H,12,14).
What are the key properties of 2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide?
2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide has a molecular weight of 202.30 g/mol, XLogP of 0.12, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-hydroxy-2-methylbutyl)amino]-N-propylacetamide is sourced from PubChem (CID 66092546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).