N-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine

C11H22N2O — CID 82739732

IUPACN-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine
SMILESCN(CC1CCC(N)C1)C1CCOC1
InChIInChI=1S/C11H22N2O/c1-13(11-4-5-14-8-11)7-9-2-3-10(12)6-9/h9-11H,2-8,12H2,1H3
InChIKeyRNUGDLBCTMQVHG-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.83
Rot. Bonds3

About N-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine

N-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine (PubChem CID 82739732) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine.

Molecular Properties

Compound NameN-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine
PubChem CID82739732
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine
SMILESCN(CC1CCC(N)C1)C1CCOC1
InChIInChI=1S/C11H22N2O/c1-13(11-4-5-14-8-11)7-9-2-3-10(12)6-9/h9-11H,2-8,12H2,1H3
InChIKeyRNUGDLBCTMQVHG-UHFFFAOYSA-N
XLogP0.83
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine?
The IUPAC name of N-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine (CID 82739732) is N-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine.
What is the SMILES notation for N-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine?
The canonical SMILES for N-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine is CN(CC1CCC(N)C1)C1CCOC1.
What is the InChIKey of N-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine?
The InChIKey is RNUGDLBCTMQVHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-13(11-4-5-14-8-11)7-9-2-3-10(12)6-9/h9-11H,2-8,12H2,1H3.
What are the key properties of N-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine?
N-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine has a molecular weight of 198.31 g/mol, XLogP of 0.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine is sourced from PubChem (CID 82739732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).