1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine

C11H22N2O — CID 43611076

IUPAC1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine
SMILESCN(C1CCOCC1)C1CCCC1N
InChIInChI=1S/C11H22N2O/c1-13(9-5-7-14-8-6-9)11-4-2-3-10(11)12/h9-11H,2-8,12H2,1H3
InChIKeySLJMJUPLHSOVRD-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.98
Rot. Bonds2

About 1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine

1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine (PubChem CID 43611076) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine.

Molecular Properties

Compound Name1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine
PubChem CID43611076
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine
SMILESCN(C1CCOCC1)C1CCCC1N
InChIInChI=1S/C11H22N2O/c1-13(9-5-7-14-8-6-9)11-4-2-3-10(11)12/h9-11H,2-8,12H2,1H3
InChIKeySLJMJUPLHSOVRD-UHFFFAOYSA-N
XLogP0.98
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine with MolForge

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

Launch Full Analysis

Related Compounds

N-(2-aminoethyl)-N-methyloxan-4-amine
CID 43610817
1-(Oxan-4-yl)piperidin-3-amine
CID 61297925
[1-(Oxan-4-yl)pyrrolidin-2-yl]methanamine
CID 18470908
1-[2-[Methyl(oxan-4-yl)amino]ethyl]piperidin-4-amine
CID 22989982
2-(4-Methoxypiperidin-1-yl)cyclopentan-1-amine
CID 23349713
N-Cyclopentyltetrahydro-2H-pyran-4-amine
CID 28694035
N,N-Dimethyl-N'-(tetrahydro-pyran-4-YL)-ethane-1,2-diamine
CID 43608310
4-(2-Pyrrolidin-1-ylethylamino)tetrahydropyran
CID 43608501
1-(Oxan-4-yl)pyrrolidin-3-amine
CID 43610259
N-methyl-1-(oxan-4-yl)pyrrolidin-3-amine
CID 43610263
N,N'-dimethyl-N'-(oxan-4-yl)ethane-1,2-diamine
CID 43611353
(S)-1-(Tetrahydro-2H-pyran-4-yl)pyrrolidin-3-amine
CID 53256288

Frequently Asked Questions

What is the IUPAC name of 1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine?
The IUPAC name of 1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine (CID 43611076) is 1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine.
What is the SMILES notation for 1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine?
The canonical SMILES for 1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine is CN(C1CCOCC1)C1CCCC1N.
What is the InChIKey of 1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine?
The InChIKey is SLJMJUPLHSOVRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-13(9-5-7-14-8-6-9)11-4-2-3-10(11)12/h9-11H,2-8,12H2,1H3.
What are the key properties of 1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine?
1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine has a molecular weight of 198.31 g/mol, XLogP of 0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-methyl-1-N-(oxan-4-yl)cyclopentane-1,2-diamine is sourced from PubChem (CID 43611076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).