N-[2-(2-methylbutoxy)ethyl]propan-2-amine

C10H23NO — CID 62342211

IUPACN-[2-(2-methylbutoxy)ethyl]propan-2-amine
SMILESCCC(C)COCCNC(C)C
InChIInChI=1S/C10H23NO/c1-5-10(4)8-12-7-6-11-9(2)3/h9-11H,5-8H2,1-4H3
InChIKeyGMCINYCRPABKGO-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.05
Rot. Bonds7

About N-[2-(2-methylbutoxy)ethyl]propan-2-amine

N-[2-(2-methylbutoxy)ethyl]propan-2-amine (PubChem CID 62342211) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is N-[2-(2-methylbutoxy)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(2-methylbutoxy)ethyl]propan-2-amine
PubChem CID62342211
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC NameN-[2-(2-methylbutoxy)ethyl]propan-2-amine
SMILESCCC(C)COCCNC(C)C
InChIInChI=1S/C10H23NO/c1-5-10(4)8-12-7-6-11-9(2)3/h9-11H,5-8H2,1-4H3
InChIKeyGMCINYCRPABKGO-UHFFFAOYSA-N
XLogP2.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-1-(2-methylbutoxy)butane
CID 4584641
N-[2-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]ethyl]propan-1-amine
CID 138727595
N-[2-(2-methylpentoxy)ethyl]pentan-3-amine
CID 103285771
3-(2-ethylbutoxy)-N-propan-2-ylpropan-1-amine
CID 82929077
N-[2-[3-[2-(propan-2-ylamino)ethoxy]-2,2-bis[2-(propan-2-ylamino)ethoxymethyl]propoxy]ethyl]propan-2-amine
CID 140945350
N-[3-(2-methylbutoxy)propyl]formamide
CID 90045792
N-(2-decoxyethyl)propan-2-amine
CID 63399572
N-[2-(2-octoxyethoxy)ethyl]propan-2-amine
CID 156795483
N-[2-(2,2-difluoroethoxy)ethyl]butan-2-amine
CID 82009436
N-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl]propan-2-amine
CID 138744855
N-[2-fluoro-3-[2-[2-(propan-2-ylamino)ethoxy]ethoxy]propyl]formamide
CID 155582507
N-[2-[2-(dimethylamino)ethoxy]ethyl]propan-2-amine
CID 62341832

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylbutoxy)ethyl]propan-2-amine?
The IUPAC name of N-[2-(2-methylbutoxy)ethyl]propan-2-amine (CID 62342211) is N-[2-(2-methylbutoxy)ethyl]propan-2-amine.
What is the SMILES notation for N-[2-(2-methylbutoxy)ethyl]propan-2-amine?
The canonical SMILES for N-[2-(2-methylbutoxy)ethyl]propan-2-amine is CCC(C)COCCNC(C)C.
What is the InChIKey of N-[2-(2-methylbutoxy)ethyl]propan-2-amine?
The InChIKey is GMCINYCRPABKGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-5-10(4)8-12-7-6-11-9(2)3/h9-11H,5-8H2,1-4H3.
What are the key properties of N-[2-(2-methylbutoxy)ethyl]propan-2-amine?
N-[2-(2-methylbutoxy)ethyl]propan-2-amine has a molecular weight of 173.30 g/mol, XLogP of 2.05, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylbutoxy)ethyl]propan-2-amine is sourced from PubChem (CID 62342211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).