4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine

C15H24N2O2 — CID 83002880

IUPAC4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine
SMILESCOC1CCCC1Nc1ccc(N)c(OC(C)C)c1
InChIInChI=1S/C15H24N2O2/c1-10(2)19-15-9-11(7-8-12(15)16)17-13-5-4-6-14(13)18-3/h7-10,13-14,17H,4-6,16H2,1-3H3
InChIKeyMUGATPPXESJULF-UHFFFAOYSA-N
MW264.37 g/mol
LogP3.04
Rot. Bonds5

About 4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine

4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine (PubChem CID 83002880) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine.

Molecular Properties

Compound Name4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine
PubChem CID83002880
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine
SMILESCOC1CCCC1Nc1ccc(N)c(OC(C)C)c1
InChIInChI=1S/C15H24N2O2/c1-10(2)19-15-9-11(7-8-12(15)16)17-13-5-4-6-14(13)18-3/h7-10,13-14,17H,4-6,16H2,1-3H3
InChIKeyMUGATPPXESJULF-UHFFFAOYSA-N
XLogP3.04
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(4-amino-3-propan-2-yloxyanilino)cyclohexan-1-ol
CID 83002746
4-N-(2-ethylcyclopropyl)-2-propan-2-yloxybenzene-1,4-diamine
CID 114107471
2-amino-4-[(2-methoxycyclopentyl)amino]benzenesulfonamide
CID 79467242
3,4-difluoro-N-(2-methoxycyclohexyl)aniline
CID 43761652
5-(4-amino-3-propan-2-yloxyanilino)piperidin-2-one
CID 83002885
4-N-(1,2-dimethylpiperidin-4-yl)-2-propan-2-yloxybenzene-1,4-diamine
CID 83002828
4-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-propan-2-yloxybenzene-1,4-diamine
CID 83002545
N-(2-methoxycyclopentyl)-4-nitroaniline
CID 62086642
1-N-(2-methoxycyclopentyl)-4-methylbenzene-1,2-diamine
CID 62088185
4-(2,2-dimethylhydrazinyl)-2-propan-2-yloxyaniline
CID 83012844
4-N-cyclopentyl-4-N-methyl-2-propan-2-yloxybenzene-1,4-diamine
CID 83002795
4-N-(2-methoxypropyl)-2-propan-2-yloxybenzene-1,4-diamine
CID 102694533

Frequently Asked Questions

What is the IUPAC name of 4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine?
The IUPAC name of 4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine (CID 83002880) is 4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine.
What is the SMILES notation for 4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine?
The canonical SMILES for 4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine is COC1CCCC1Nc1ccc(N)c(OC(C)C)c1.
What is the InChIKey of 4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine?
The InChIKey is MUGATPPXESJULF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-10(2)19-15-9-11(7-8-12(15)16)17-13-5-4-6-14(13)18-3/h7-10,13-14,17H,4-6,16H2,1-3H3.
What are the key properties of 4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine?
4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine has a molecular weight of 264.37 g/mol, XLogP of 3.04, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(2-methoxycyclopentyl)-2-propan-2-yloxybenzene-1,4-diamine is sourced from PubChem (CID 83002880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).