5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide

C10H22N2O2 — CID 106233905

IUPAC5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide
SMILESCC(C)(CO)CNCCCCC(N)=O
InChIInChI=1S/C10H22N2O2/c1-10(2,8-13)7-12-6-4-3-5-9(11)14/h12-13H,3-8H2,1-2H3,(H2,11,14)
InChIKeyOZZZAKZZRSKEIB-UHFFFAOYSA-N
MW202.30 g/mol
LogP0.25
Rot. Bonds8

About 5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide

5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide (PubChem CID 106233905) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide.

Molecular Properties

Compound Name5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide
PubChem CID106233905
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide
SMILESCC(C)(CO)CNCCCCC(N)=O
InChIInChI=1S/C10H22N2O2/c1-10(2,8-13)7-12-6-4-3-5-9(11)14/h12-13H,3-8H2,1-2H3,(H2,11,14)
InChIKeyOZZZAKZZRSKEIB-UHFFFAOYSA-N
XLogP0.25
TPSA75.35 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 ≤ 50.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[(3-hydroxy-2,2-dimethylpropyl)amino]propanamide
CID 81414518
6-[(3-hydroxy-2,2-dimethylpropyl)amino]hexanoic acid
CID 115359916
3-[4-(dimethylamino)butylamino]-2,2-dimethylpropan-1-ol
CID 81412054
3-(4-methoxybutylamino)-2,2-dimethylpropan-1-ol
CID 81410944
6-(decylamino)hexanamide
CID 13292350
12-(hexylamino)dodecanamide
CID 174861179
tert-butyl 3-[(5-amino-5-oxopentyl)amino]propanoate
CID 106238269
5-[(4-amino-4-hydroxyimino-3,3-dimethylbutyl)amino]pentanamide
CID 114162300
5-(4-hydroxybutylamino)-4,4-dimethylpentan-1-ol
CID 106147208
[3-(butylamino)-2,2-dimethylpropyl]urea
CID 22381207
[3-(butylamino)-2,2-dimethylpropyl] carbamate
CID 87971522
5-amino-N-(3-hydroxy-2,2-dimethylpropyl)pentanamide
CID 115360270

Frequently Asked Questions

What is the IUPAC name of 5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide?
The IUPAC name of 5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide (CID 106233905) is 5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide.
What is the SMILES notation for 5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide?
The canonical SMILES for 5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide is CC(C)(CO)CNCCCCC(N)=O.
What is the InChIKey of 5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide?
The InChIKey is OZZZAKZZRSKEIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-10(2,8-13)7-12-6-4-3-5-9(11)14/h12-13H,3-8H2,1-2H3,(H2,11,14).
What are the key properties of 5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide?
5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide has a molecular weight of 202.30 g/mol, XLogP of 0.25, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-hydroxy-2,2-dimethylpropyl)amino]pentanamide is sourced from PubChem (CID 106233905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).