N-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine

C12H25N — CID 123276908

IUPACN-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine
SMILESCCN(C)CC1CC1(C)CC(C)C
InChIInChI=1S/C12H25N/c1-6-13(5)9-11-8-12(11,4)7-10(2)3/h10-11H,6-9H2,1-5H3
InChIKeyLGQLNEOSISZFGP-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.01
Rot. Bonds5

About N-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine

N-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine (PubChem CID 123276908) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is N-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine.

Molecular Properties

Compound NameN-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine
PubChem CID123276908
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC NameN-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine
SMILESCCN(C)CC1CC1(C)CC(C)C
InChIInChI=1S/C12H25N/c1-6-13(5)9-11-8-12(11,4)7-10(2)3/h10-11H,6-9H2,1-5H3
InChIKeyLGQLNEOSISZFGP-UHFFFAOYSA-N
XLogP3.01
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine?
The IUPAC name of N-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine (CID 123276908) is N-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine.
What is the SMILES notation for N-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine?
The canonical SMILES for N-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine is CCN(C)CC1CC1(C)CC(C)C.
What is the InChIKey of N-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine?
The InChIKey is LGQLNEOSISZFGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-6-13(5)9-11-8-12(11,4)7-10(2)3/h10-11H,6-9H2,1-5H3.
What are the key properties of N-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine?
N-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine has a molecular weight of 183.34 g/mol, XLogP of 3.01, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[2-methyl-2-(2-methylpropyl)cyclopropyl]methyl]ethanamine is sourced from PubChem (CID 123276908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).