N-cyclopentyl-2-methoxy-4-methylaniline

C13H19NO — CID 60932098

IUPACN-cyclopentyl-2-methoxy-4-methylaniline
SMILESCOc1cc(C)ccc1NC1CCCC1
InChIInChI=1S/C13H19NO/c1-10-7-8-12(13(9-10)15-2)14-11-5-3-4-6-11/h7-9,11,14H,3-6H2,1-2H3
InChIKeyJXCRUFQXVOZZLV-UHFFFAOYSA-N
MW205.30 g/mol
LogP3.36
Rot. Bonds3

About N-cyclopentyl-2-methoxy-4-methylaniline

N-cyclopentyl-2-methoxy-4-methylaniline (PubChem CID 60932098) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is N-cyclopentyl-2-methoxy-4-methylaniline.

Molecular Properties

Compound NameN-cyclopentyl-2-methoxy-4-methylaniline
PubChem CID60932098
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC NameN-cyclopentyl-2-methoxy-4-methylaniline
SMILESCOc1cc(C)ccc1NC1CCCC1
InChIInChI=1S/C13H19NO/c1-10-7-8-12(13(9-10)15-2)14-11-5-3-4-6-11/h7-9,11,14H,3-6H2,1-2H3
InChIKeyJXCRUFQXVOZZLV-UHFFFAOYSA-N
XLogP3.36
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-methoxy-4-methylphenyl)cycloheptanamine
CID 54865924
N-[2-(2-methoxyethoxy)-4-methylphenyl]cycloheptanamine
CID 60934945
N-(2-methoxy-4-methylphenyl)thiolan-3-amine
CID 60932234
methyl 2-(cyclopentylamino)-5-methylbenzoate
CID 43679174
2-cyclopentyloxy-1-methoxy-4-methylbenzene;ethane
CID 142884364
N-cyclopentyl-4-methoxy-2-methylaniline
CID 62867512
4-chloro-N-cyclopentyl-2-methoxy-5-methylaniline
CID 30050493
N-cyclohexyl-4-methoxy-2-methylaniline
CID 62867173
2-methoxy-4-methyl-N-propan-2-ylaniline
CID 59391426
4,4-dimethyl-N-(4-methyl-2-propoxyphenyl)cycloheptan-1-amine
CID 65083053
N-(2-methoxy-5-methylphenyl)-1-propan-2-ylazepan-4-amine
CID 65072841
2-methoxy-4-methyl-N-(2-pyrrolidin-2-ylcyclohexyl)aniline
CID 79536682

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methoxy-4-methylaniline?
The IUPAC name of N-cyclopentyl-2-methoxy-4-methylaniline (CID 60932098) is N-cyclopentyl-2-methoxy-4-methylaniline.
What is the SMILES notation for N-cyclopentyl-2-methoxy-4-methylaniline?
The canonical SMILES for N-cyclopentyl-2-methoxy-4-methylaniline is COc1cc(C)ccc1NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-methoxy-4-methylaniline?
The InChIKey is JXCRUFQXVOZZLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-10-7-8-12(13(9-10)15-2)14-11-5-3-4-6-11/h7-9,11,14H,3-6H2,1-2H3.
What are the key properties of N-cyclopentyl-2-methoxy-4-methylaniline?
N-cyclopentyl-2-methoxy-4-methylaniline has a molecular weight of 205.30 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methoxy-4-methylaniline is sourced from PubChem (CID 60932098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).