N-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine

C13H25N — CID 105049630

IUPACN-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine
SMILESCCNC(C1CCC1)C1(C)CCCC1
InChIInChI=1S/C13H25N/c1-3-14-12(11-7-6-8-11)13(2)9-4-5-10-13/h11-12,14H,3-10H2,1-2H3
InChIKeyJNLLMPZSRIRXRF-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.34
Rot. Bonds4

About N-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine

N-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine (PubChem CID 105049630) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is N-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine
PubChem CID105049630
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC NameN-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine
SMILESCCNC(C1CCC1)C1(C)CCCC1
InChIInChI=1S/C13H25N/c1-3-14-12(11-7-6-8-11)13(2)9-4-5-10-13/h11-12,14H,3-10H2,1-2H3
InChIKeyJNLLMPZSRIRXRF-UHFFFAOYSA-N
XLogP3.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine?
The IUPAC name of N-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine (CID 105049630) is N-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine.
What is the SMILES notation for N-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine?
The canonical SMILES for N-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine is CCNC(C1CCC1)C1(C)CCCC1.
What is the InChIKey of N-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine?
The InChIKey is JNLLMPZSRIRXRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-3-14-12(11-7-6-8-11)13(2)9-4-5-10-13/h11-12,14H,3-10H2,1-2H3.
What are the key properties of N-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine?
N-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine has a molecular weight of 195.35 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclobutyl-(1-methylcyclopentyl)methyl]ethanamine is sourced from PubChem (CID 105049630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).