N-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine

C13H26N2 — CID 81004867

IUPACN-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine
SMILESCNCC1CCC1N(C)CC1CCCC1
InChIInChI=1S/C13H26N2/c1-14-9-12-7-8-13(12)15(2)10-11-5-3-4-6-11/h11-14H,3-10H2,1-2H3
InChIKeyAYKLTTRSIOCTKS-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.11
Rot. Bonds5

About N-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine

N-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine (PubChem CID 81004867) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine
PubChem CID81004867
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine
SMILESCNCC1CCC1N(C)CC1CCCC1
InChIInChI=1S/C13H26N2/c1-14-9-12-7-8-13(12)15(2)10-11-5-3-4-6-11/h11-14H,3-10H2,1-2H3
InChIKeyAYKLTTRSIOCTKS-UHFFFAOYSA-N
XLogP2.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine?
The IUPAC name of N-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine (CID 81004867) is N-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine.
What is the SMILES notation for N-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine?
The canonical SMILES for N-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine is CNCC1CCC1N(C)CC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine?
The InChIKey is AYKLTTRSIOCTKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-14-9-12-7-8-13(12)15(2)10-11-5-3-4-6-11/h11-14H,3-10H2,1-2H3.
What are the key properties of N-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine?
N-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine has a molecular weight of 210.36 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-N-methyl-2-(methylaminomethyl)cyclobutan-1-amine is sourced from PubChem (CID 81004867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).