5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide

C11H25N3O2 — CID 106148441

IUPAC5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide
SMILESCN(C)CC(C)(O)CNC(=O)CCCCN
InChIInChI=1S/C11H25N3O2/c1-11(16,9-14(2)3)8-13-10(15)6-4-5-7-12/h16H,4-9,12H2,1-3H3,(H,13,15)
InChIKeyFQLSCGVBAPNQIJ-UHFFFAOYSA-N
MW231.34 g/mol
LogP-0.46
Rot. Bonds8

About 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide

5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide (PubChem CID 106148441) has the molecular formula C11H25N3O2 and a molecular weight of 231.34 g/mol. Its IUPAC name is 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide.

Molecular Properties

Compound Name5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide
PubChem CID106148441
Molecular FormulaC11H25N3O2
Molecular Weight231.34 g/mol
Exact Mass231.19
IUPAC Name5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide
SMILESCN(C)CC(C)(O)CNC(=O)CCCCN
InChIInChI=1S/C11H25N3O2/c1-11(16,9-14(2)3)8-13-10(15)6-4-5-7-12/h16H,4-9,12H2,1-3H3,(H,13,15)
InChIKeyFQLSCGVBAPNQIJ-UHFFFAOYSA-N
XLogP-0.46
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 5-0.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]hexanamide
CID 24697839
7-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]heptanamide
CID 24701938
5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-4-methylpentanamide
CID 106148529
6-amino-N-(2-hydroxy-2-methylpropyl)hexanamide
CID 65106883
6-amino-N-[2-(dimethylamino)-2-methylpropyl]hexanamide
CID 61249637
ethyl 4-[[3-(dimethylamino)-2-hydroxy-2-methylpropyl]amino]-4-oxobutanoate
CID 103839873
4-cyclohexyl-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]butanamide
CID 103839791
5-amino-N-(3-hydroxy-2,2-dimethylpropyl)pentanamide
CID 115360270
5-amino-N-(2-methyl-2-methylsulfonylpropyl)pentanamide
CID 79550040
1-(3-aminopropylamino)-3-(dimethylamino)-2-methylpropan-2-ol
CID 106145231
7-amino-N-(2-methyl-2-methylsulfonylpropyl)heptanamide
CID 79550577
5-amino-N-(4-hydroxy-2,2-dimethylbutyl)pentanamide
CID 106147943

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide?
The IUPAC name of 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide (CID 106148441) is 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide.
What is the SMILES notation for 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide?
The canonical SMILES for 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide is CN(C)CC(C)(O)CNC(=O)CCCCN.
What is the InChIKey of 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide?
The InChIKey is FQLSCGVBAPNQIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O2/c1-11(16,9-14(2)3)8-13-10(15)6-4-5-7-12/h16H,4-9,12H2,1-3H3,(H,13,15).
What are the key properties of 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide?
5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide has a molecular weight of 231.34 g/mol, XLogP of -0.46, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]pentanamide is sourced from PubChem (CID 106148441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).