N-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine

C14H29N — CID 154937343

IUPACN-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine
SMILESCCC(C)N(C)C(C)C1CC(C(C)C)C1
InChIInChI=1S/C14H29N/c1-7-11(4)15(6)12(5)14-8-13(9-14)10(2)3/h10-14H,7-9H2,1-6H3
InChIKeyMIRGCJJLTJIFBJ-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.79
Rot. Bonds5

About N-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine

N-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine (PubChem CID 154937343) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is N-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine.

Molecular Properties

Compound NameN-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine
PubChem CID154937343
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC NameN-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine
SMILESCCC(C)N(C)C(C)C1CC(C(C)C)C1
InChIInChI=1S/C14H29N/c1-7-11(4)15(6)12(5)14-8-13(9-14)10(2)3/h10-14H,7-9H2,1-6H3
InChIKeyMIRGCJJLTJIFBJ-UHFFFAOYSA-N
XLogP3.79
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine?
The IUPAC name of N-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine (CID 154937343) is N-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine.
What is the SMILES notation for N-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine?
The canonical SMILES for N-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine is CCC(C)N(C)C(C)C1CC(C(C)C)C1.
What is the InChIKey of N-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine?
The InChIKey is MIRGCJJLTJIFBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-7-11(4)15(6)12(5)14-8-13(9-14)10(2)3/h10-14H,7-9H2,1-6H3.
What are the key properties of N-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine?
N-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine has a molecular weight of 211.39 g/mol, XLogP of 3.79, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(3-propan-2-ylcyclobutyl)ethyl]butan-2-amine is sourced from PubChem (CID 154937343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).