3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine

C12H23NO — CID 114543980

IUPAC3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine
SMILESCC1CCC(NCC2CCC(C)O2)C1
InChIInChI=1S/C12H23NO/c1-9-3-5-11(7-9)13-8-12-6-4-10(2)14-12/h9-13H,3-8H2,1-2H3
InChIKeyGIYNIQITTBTONL-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.33
Rot. Bonds3

About 3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine

3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine (PubChem CID 114543980) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Name3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine
PubChem CID114543980
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine
SMILESCC1CCC(NCC2CCC(C)O2)C1
InChIInChI=1S/C12H23NO/c1-9-3-5-11(7-9)13-8-12-6-4-10(2)14-12/h9-13H,3-8H2,1-2H3
InChIKeyGIYNIQITTBTONL-UHFFFAOYSA-N
XLogP2.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopropan-1-amine
CID 82835970
N-[(5-methyloxolan-2-yl)methyl]oxan-4-amine
CID 82834063
1,2-dimethyl-N-[(5-methyloxolan-2-yl)methyl]piperidin-4-amine
CID 82836292
N-[(5-methyloxolan-2-yl)methyl]cyclohex-3-en-1-amine
CID 82836681
2-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine
CID 82835668
N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine
CID 130921273
2-methoxy-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine
CID 82836271
3-[(5-methyloxolan-2-yl)methyl]-N-propylcyclohexan-1-amine
CID 103131852
5-[[(4-methylcyclohexyl)amino]methyl]oxolane-2-carboxylic acid
CID 103234012
N-(azetidin-3-ylmethyl)-3-methylcyclopentan-1-amine
CID 114547373
2-methyl-1-[4-[(5-methyloxolan-2-yl)methylamino]piperidin-1-yl]propan-1-one
CID 82836447
3-methyl-N-[(1-methylpiperidin-3-yl)methyl]cyclopentan-1-amine
CID 64502172

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine?
The IUPAC name of 3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine (CID 114543980) is 3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine.
What is the SMILES notation for 3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine?
The canonical SMILES for 3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine is CC1CCC(NCC2CCC(C)O2)C1.
What is the InChIKey of 3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine?
The InChIKey is GIYNIQITTBTONL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-9-3-5-11(7-9)13-8-12-6-4-10(2)14-12/h9-13H,3-8H2,1-2H3.
What are the key properties of 3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine?
3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine has a molecular weight of 197.32 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[(5-methyloxolan-2-yl)methyl]cyclopentan-1-amine is sourced from PubChem (CID 114543980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).