N-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide

C13H28N2O — CID 106140775

IUPACN-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide
SMILESCCCC(C)C(=O)NCC(C)(C)CCCN
InChIInChI=1S/C13H28N2O/c1-5-7-11(2)12(16)15-10-13(3,4)8-6-9-14/h11H,5-10,14H2,1-4H3,(H,15,16)
InChIKeyGCSMPRYXGLGCDD-UHFFFAOYSA-N
MW228.38 g/mol
LogP2.30
Rot. Bonds8

About N-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide

N-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide (PubChem CID 106140775) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is N-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide.

Molecular Properties

Compound NameN-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide
PubChem CID106140775
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC NameN-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide
SMILESCCCC(C)C(=O)NCC(C)(C)CCCN
InChIInChI=1S/C13H28N2O/c1-5-7-11(2)12(16)15-10-13(3,4)8-6-9-14/h11H,5-10,14H2,1-4H3,(H,15,16)
InChIKeyGCSMPRYXGLGCDD-UHFFFAOYSA-N
XLogP2.30
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-(2,2-dimethylheptyl)-2-methylbutanamide
CID 80544365
N-(5-bromo-2,2-dimethylpentyl)-2-methylpentanamide
CID 106145156
N-(4-amino-2,2-dimethylbutyl)-3-methyl-2-propan-2-ylbutanamide
CID 114282359
N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylbutanamide
CID 106140383
N-(3-amino-2,2-dimethylpropyl)-2-propylpentanamide
CID 82987576
N-(1-amino-3-methylpentan-3-yl)-2-methylpentanamide
CID 106164528
N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide
CID 106140502
5-amino-N-ethyl-2-methylpentanamide
CID 134525204
5-amino-2-methyl-N-pentylpentanamide
CID 104683456
4-amino-2-methyl-N-(4,4,4-trifluorobutyl)butanamide
CID 115519191
(2R)-2-(2,2-dimethylheptylcarbamoylamino)pentanoic acid
CID 107567309
4-amino-N-(3-aminopropyl)-2-methylbutanamide
CID 80543775

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide?
The IUPAC name of N-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide (CID 106140775) is N-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide.
What is the SMILES notation for N-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide?
The canonical SMILES for N-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide is CCCC(C)C(=O)NCC(C)(C)CCCN.
What is the InChIKey of N-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide?
The InChIKey is GCSMPRYXGLGCDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-5-7-11(2)12(16)15-10-13(3,4)8-6-9-14/h11H,5-10,14H2,1-4H3,(H,15,16).
What are the key properties of N-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide?
N-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide has a molecular weight of 228.38 g/mol, XLogP of 2.30, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2,2-dimethylpentyl)-2-methylpentanamide is sourced from PubChem (CID 106140775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).