4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide

C12H26N2O2 — CID 66172265

IUPAC4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide
SMILESCC(C)CC(C)(O)CNC(=O)CCC(C)N
InChIInChI=1S/C12H26N2O2/c1-9(2)7-12(4,16)8-14-11(15)6-5-10(3)13/h9-10,16H,5-8,13H2,1-4H3,(H,14,15)
InChIKeyVQPMPIKUGJDTJL-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.03
Rot. Bonds7

About 4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide

4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide (PubChem CID 66172265) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide.

Molecular Properties

Compound Name4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide
PubChem CID66172265
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide
SMILESCC(C)CC(C)(O)CNC(=O)CCC(C)N
InChIInChI=1S/C12H26N2O2/c1-9(2)7-12(4,16)8-14-11(15)6-5-10(3)13/h9-10,16H,5-8,13H2,1-4H3,(H,14,15)
InChIKeyVQPMPIKUGJDTJL-UHFFFAOYSA-N
XLogP1.03
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)pentanamide
CID 106247633
N-(2-hydroxy-2,4-dimethylpentyl)pentanamide
CID 66178352
3-ethoxy-N-(2-hydroxy-2,4-dimethylpentyl)propanamide
CID 66179484
4-amino-N-(2-ethyl-2-hydroxybutyl)pentanamide
CID 65106683
(2S)-2-amino-N-[2-[(2-hydroxy-2,4-dimethylpentyl)amino]-2-oxoethyl]-3-methylbutanamide
CID 82962399
2-acetamido-N-(2-hydroxy-2,4-dimethylpentyl)acetamide
CID 66178769
(2R)-2-amino-N-(2-hydroxy-2,4-dimethylpentyl)-4-methylpentanamide
CID 104903660
N-(2-hydroxy-2,4-dimethylpentyl)-2-methylpropanamide
CID 66180454
N-(2-hydroxy-2,4-dimethylpentyl)-2,2-dimethylpropanamide
CID 66180259
1-amino-N-(2-hydroxy-2,4-dimethylpentyl)cyclopropane-1-carboxamide
CID 66172259
N-(2-hydroxy-2,4-dimethylpentyl)-2-propylpentanamide
CID 82986949
N-(2-hydroxy-2,4-dimethylpentyl)-3-(1,2,4-triazol-1-yl)propanamide
CID 66181091

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide?
The IUPAC name of 4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide (CID 66172265) is 4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide.
What is the SMILES notation for 4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide?
The canonical SMILES for 4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide is CC(C)CC(C)(O)CNC(=O)CCC(C)N.
What is the InChIKey of 4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide?
The InChIKey is VQPMPIKUGJDTJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-9(2)7-12(4,16)8-14-11(15)6-5-10(3)13/h9-10,16H,5-8,13H2,1-4H3,(H,14,15).
What are the key properties of 4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide?
4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide has a molecular weight of 230.35 g/mol, XLogP of 1.03, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-hydroxy-2,4-dimethylpentyl)pentanamide is sourced from PubChem (CID 66172265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).