N-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine

C11H23NO — CID 103897079

IUPACN-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine
SMILESCCC(C)CNCCOCC1CC1
InChIInChI=1S/C11H23NO/c1-3-10(2)8-12-6-7-13-9-11-4-5-11/h10-12H,3-9H2,1-2H3
InChIKeyFTYSTORBVYXCLJ-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.05
Rot. Bonds8

About N-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine

N-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine (PubChem CID 103897079) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is N-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine.

Molecular Properties

Compound NameN-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine
PubChem CID103897079
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC NameN-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine
SMILESCCC(C)CNCCOCC1CC1
InChIInChI=1S/C11H23NO/c1-3-10(2)8-12-6-7-13-9-11-4-5-11/h10-12H,3-9H2,1-2H3
InChIKeyFTYSTORBVYXCLJ-UHFFFAOYSA-N
XLogP2.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
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-N-(2-undecoxyethyl)butan-1-amine
CID 22091443
1-[2-[2-(2-methylbutylamino)ethoxy]ethyl]piperidin-4-amine
CID 169213807
N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-methylbutan-1-amine
CID 104562209
2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]butan-1-amine
CID 142623041
1-[2-(cyclopropylmethoxy)ethylamino]-3-(2-ethoxyethoxy)propan-2-ol
CID 114097862
N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen
CID 156794535
2-methyl-N-[3-(oxolan-2-ylmethoxy)propyl]butan-1-amine
CID 43205736
2-(cyclobutylmethoxy)-N-ethylethanamine
CID 65457853
N-[3-(cyclopropylmethoxy)propyl]butan-2-amine
CID 43206788
2-(cyclopropylmethoxy)-N-[(4-methylcyclohexyl)methyl]ethanamine
CID 115868513
N-(cyclopentylmethyl)-2-(cyclopropylmethoxy)ethanamine
CID 62599762
N-(cyclopentylmethyl)-2-methylbutan-1-amine
CID 43370775

Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine?
The IUPAC name of N-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine (CID 103897079) is N-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine.
What is the SMILES notation for N-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine?
The canonical SMILES for N-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine is CCC(C)CNCCOCC1CC1.
What is the InChIKey of N-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine?
The InChIKey is FTYSTORBVYXCLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-10(2)8-12-6-7-13-9-11-4-5-11/h10-12H,3-9H2,1-2H3.
What are the key properties of N-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine?
N-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine has a molecular weight of 185.31 g/mol, XLogP of 2.05, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine is sourced from PubChem (CID 103897079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).