N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide

C12H26N2O2 — CID 112603533

IUPACN-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCCCCC(CN)NC(=O)COC(C)(C)C
InChIInChI=1S/C12H26N2O2/c1-5-6-7-10(8-13)14-11(15)9-16-12(2,3)4/h10H,5-9,13H2,1-4H3,(H,14,15)
InChIKeyQDDYQJIQKCJFCC-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.44
Rot. Bonds7

About N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide

N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide (PubChem CID 112603533) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide.

Molecular Properties

Compound NameN-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
PubChem CID112603533
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC NameN-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
SMILESCCCCC(CN)NC(=O)COC(C)(C)C
InChIInChI=1S/C12H26N2O2/c1-5-6-7-10(8-13)14-11(15)9-16-12(2,3)4/h10H,5-9,13H2,1-4H3,(H,14,15)
InChIKeyQDDYQJIQKCJFCC-UHFFFAOYSA-N
XLogP1.44
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 ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-aminohexan-2-yl)-3-methoxy-3-methylbutanamide
CID 103021601
N-(1-aminohexan-2-yl)-2-(2-methoxyethoxy)acetamide;hydrochloride
CID 119667872
2-amino-N-(1-aminohexan-2-yl)-2-methylpentanamide
CID 122080967
N-[2-(1-aminohexan-2-ylamino)-2-oxoethyl]-3,3-dimethylbutanamide
CID 119666894
N-(1-aminohexan-2-yl)-3-propoxypropanamide
CID 80697621
N-(1-hydroxybutan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112603120
N-(1-aminohexan-2-yl)-3-methylpentanamide
CID 114875681
N-(1-aminohexan-2-yl)-2-(4-ethylphenoxy)acetamide;hydrochloride
CID 119665333
N-(1-aminohexan-2-yl)-2-(4-propan-2-ylphenoxy)acetamide;hydrochloride
CID 119667507
N-(1-aminohexan-2-yl)-2-(cyclopropylmethylamino)acetamide
CID 122080965
(2S)-2-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]pentanoic acid
CID 107564514
N'-(1-aminohexan-2-yl)-N-ethylpentanediamide;hydrochloride
CID 119668224

Frequently Asked Questions

What is the IUPAC name of N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The IUPAC name of N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide (CID 112603533) is N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide.
What is the SMILES notation for N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The canonical SMILES for N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide is CCCCC(CN)NC(=O)COC(C)(C)C.
What is the InChIKey of N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
The InChIKey is QDDYQJIQKCJFCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-5-6-7-10(8-13)14-11(15)9-16-12(2,3)4/h10H,5-9,13H2,1-4H3,(H,14,15).
What are the key properties of N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide?
N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide has a molecular weight of 230.35 g/mol, XLogP of 1.44, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-aminohexan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide is sourced from PubChem (CID 112603533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).