N-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide

C15H31NO2 — CID 82986949

IUPACN-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide
SMILESCCCC(CCC)C(=O)NCC(C)(O)CC(C)C
InChIInChI=1S/C15H31NO2/c1-6-8-13(9-7-2)14(17)16-11-15(5,18)10-12(3)4/h12-13,18H,6-11H2,1-5H3,(H,16,17)
InChIKeyGOYWXVJDAZFEIW-UHFFFAOYSA-N
MW257.42 g/mol
LogP3.12
Rot. Bonds9

About N-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide

N-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide (PubChem CID 82986949) has the molecular formula C15H31NO2 and a molecular weight of 257.42 g/mol. Its IUPAC name is N-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide.

Molecular Properties

Compound NameN-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide
PubChem CID82986949
Molecular FormulaC15H31NO2
Molecular Weight257.42 g/mol
Exact Mass257.24
IUPAC NameN-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide
SMILESCCCC(CCC)C(=O)NCC(C)(O)CC(C)C
InChIInChI=1S/C15H31NO2/c1-6-8-13(9-7-2)14(17)16-11-15(5,18)10-12(3)4/h12-13,18H,6-11H2,1-5H3,(H,16,17)
InChIKeyGOYWXVJDAZFEIW-UHFFFAOYSA-N
XLogP3.12
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-hydroxy-2,4-dimethylpentyl)-2-methylpropanamide
CID 66180454
3-[(2-hydroxy-2,4-dimethylpentyl)amino]-2-methyl-3-oxopropanoic acid
CID 114898712
(2R)-2-amino-N-(2-hydroxy-2,4-dimethylpentyl)-4-methylpentanamide
CID 104903660
N-(3-amino-2,2-dimethylpropyl)-2-propylpentanamide
CID 82987576
N-(2-hydroxy-2,4-dimethylpentyl)pentanamide
CID 66178352
N-(2-hydroxy-2,4-dimethylpentyl)-2,2-dimethylpropanamide
CID 66180259
4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide
CID 66172265
1-amino-N-(2-hydroxy-2,4-dimethylpentyl)cyclopropane-1-carboxamide
CID 66172259
N-(2-hydroxy-2,4-dimethylpentyl)but-2-enamide
CID 77114238
2-acetamido-N-(2-hydroxy-2,4-dimethylpentyl)acetamide
CID 66178769
N-(2-hydroxy-2,4-dimethylpentyl)-2-methylpent-2-enamide
CID 77114221
(2R)-2-amino-N-(2-hydroxy-2-methylpentyl)-4-methylpentanamide
CID 106292244

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide?
The IUPAC name of N-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide (CID 82986949) is N-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide.
What is the SMILES notation for N-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide?
The canonical SMILES for N-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide is CCCC(CCC)C(=O)NCC(C)(O)CC(C)C.
What is the InChIKey of N-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide?
The InChIKey is GOYWXVJDAZFEIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31NO2/c1-6-8-13(9-7-2)14(17)16-11-15(5,18)10-12(3)4/h12-13,18H,6-11H2,1-5H3,(H,16,17).
What are the key properties of N-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide?
N-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide has a molecular weight of 257.42 g/mol, XLogP of 3.12, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide is sourced from PubChem (CID 82986949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).