2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine

C11H25NO — CID 103984222

IUPAC2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine
SMILESCCNCC(COCC)CC(C)C
InChIInChI=1S/C11H25NO/c1-5-12-8-11(7-10(3)4)9-13-6-2/h10-12H,5-9H2,1-4H3
InChIKeyCAXJRXVYQKWYSU-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.29
Rot. Bonds8

About 2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine

2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine (PubChem CID 103984222) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is 2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine.

Molecular Properties

Compound Name2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine
PubChem CID103984222
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Name2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine
SMILESCCNCC(COCC)CC(C)C
InChIInChI=1S/C11H25NO/c1-5-12-8-11(7-10(3)4)9-13-6-2/h10-12H,5-9H2,1-4H3
InChIKeyCAXJRXVYQKWYSU-UHFFFAOYSA-N
XLogP2.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopropylmethoxymethyl)-N-ethyl-4-methylpentan-1-amine
CID 106930589
4-(ethoxymethyl)-2-methylhexane
CID 157265485
2-(ethoxymethyl)-N-(2-methylpropyl)pentan-1-amine
CID 103984246
N-ethyl-2-(2-methylpropyl)decan-1-amine
CID 55194495
2-(ethoxymethyl)-N-propylbutan-1-amine
CID 103984257
CID 88668128
CID 88668128
2-(ethoxymethyl)-N-ethyl-3-(2-fluorophenyl)propan-1-amine
CID 103984391
2-[(2-bromo-5-methoxyphenyl)methyl]-N-ethyl-4-methylpentan-1-amine
CID 65327017
5-ethoxy-N-ethyl-2-methylpentan-1-amine
CID 64665808
2-(2-ethoxyethyl)-N,4-dimethylpentan-1-amine
CID 62528504
2-(ethoxymethyl)-N-ethyl-3-(3-fluorophenyl)propan-1-amine
CID 103984333
N-ethyl-4-methyl-2-(3-methylsulfonylpropyl)pentan-1-amine
CID 63195970

Frequently Asked Questions

What is the IUPAC name of 2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine?
The IUPAC name of 2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine (CID 103984222) is 2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine.
What is the SMILES notation for 2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine?
The canonical SMILES for 2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine is CCNCC(COCC)CC(C)C.
What is the InChIKey of 2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine?
The InChIKey is CAXJRXVYQKWYSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-5-12-8-11(7-10(3)4)9-13-6-2/h10-12H,5-9H2,1-4H3.
What are the key properties of 2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine?
2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine has a molecular weight of 187.33 g/mol, XLogP of 2.29, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethoxymethyl)-N-ethyl-4-methylpentan-1-amine is sourced from PubChem (CID 103984222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).