2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide

C12H26N2O2 — CID 65049075

IUPAC2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)NC(COC)C(C)C
InChIInChI=1S/C12H26N2O2/c1-6-7-12(4,13)11(15)14-10(8-16-5)9(2)3/h9-10H,6-8,13H2,1-5H3,(H,14,15)
InChIKeyJOKIQCMWSUAYDV-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.29
Rot. Bonds7

About 2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide

2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide (PubChem CID 65049075) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide
PubChem CID65049075
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)NC(COC)C(C)C
InChIInChI=1S/C12H26N2O2/c1-6-7-12(4,13)11(15)14-10(8-16-5)9(2)3/h9-10H,6-8,13H2,1-5H3,(H,14,15)
InChIKeyJOKIQCMWSUAYDV-UHFFFAOYSA-N
XLogP1.29
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[(2-amino-2-methylpentanoyl)amino]-3-methylpentanoate
CID 54928348
2-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)-2-methylpentanamide
CID 106345053
2-[(2-amino-2-methylpentanoyl)amino]propanoic acid
CID 61157718
2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide
CID 119796586
2-amino-N-(2-methoxyethyl)-2-methylpentanamide
CID 60848561
ethyl 2-[(1-methoxy-3-methylbutan-2-yl)amino]-2-oxoacetate
CID 65048237
N-[(2S)-1-methoxy-3-methylbutan-2-yl]acetamide
CID 167034901
N-(1-methoxy-3-methylbutan-2-yl)acetamide
CID 65053654
2-amino-N-(1-cyanopropan-2-yl)-2-methylpentanamide
CID 62093373
2-amino-2-methyl-N-(6-methylheptan-2-yl)pentanamide;hydrochloride
CID 119673366
2-amino-3-methoxy-N-(1-methoxy-3-methylbutan-2-yl)propanamide
CID 81101107
(2S)-2-[(2-amino-2-methylpentanoyl)amino]pentanoic acid
CID 103869776

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide?
The IUPAC name of 2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide (CID 65049075) is 2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide.
What is the SMILES notation for 2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide?
The canonical SMILES for 2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide is CCCC(C)(N)C(=O)NC(COC)C(C)C.
What is the InChIKey of 2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide?
The InChIKey is JOKIQCMWSUAYDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-6-7-12(4,13)11(15)14-10(8-16-5)9(2)3/h9-10H,6-8,13H2,1-5H3,(H,14,15).
What are the key properties of 2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide?
2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide has a molecular weight of 230.35 g/mol, XLogP of 1.29, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide is sourced from PubChem (CID 65049075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).