2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine

C12H25NO — CID 139927550

IUPAC2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine
SMILESCCCC(COC)(CN(C)C)C1CC1
InChIInChI=1S/C12H25NO/c1-5-8-12(10-14-4,9-13(2)3)11-6-7-11/h11H,5-10H2,1-4H3
InChIKeyQECVJIQKMVRXNC-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.39
Rot. Bonds7

About 2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine

2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine (PubChem CID 139927550) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine.

Molecular Properties

Compound Name2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine
PubChem CID139927550
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine
SMILESCCCC(COC)(CN(C)C)C1CC1
InChIInChI=1S/C12H25NO/c1-5-8-12(10-14-4,9-13(2)3)11-6-7-11/h11H,5-10H2,1-4H3
InChIKeyQECVJIQKMVRXNC-UHFFFAOYSA-N
XLogP2.39
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine?
The IUPAC name of 2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine (CID 139927550) is 2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine.
What is the SMILES notation for 2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine?
The canonical SMILES for 2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine is CCCC(COC)(CN(C)C)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine?
The InChIKey is QECVJIQKMVRXNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-5-8-12(10-14-4,9-13(2)3)11-6-7-11/h11H,5-10H2,1-4H3.
What are the key properties of 2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine?
2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine has a molecular weight of 199.34 g/mol, XLogP of 2.39, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(methoxymethyl)-N,N-dimethylpentan-1-amine is sourced from PubChem (CID 139927550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).