4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine

C11H23NO — CID 103032155

IUPAC4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine
SMILESCOC(C)(C)CCC(N)C1CC1C
InChIInChI=1S/C11H23NO/c1-8-7-9(8)10(12)5-6-11(2,3)13-4/h8-10H,5-7,12H2,1-4H3
InChIKeyANHCPVVQJBIISJ-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.17
Rot. Bonds5

About 4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine

4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine (PubChem CID 103032155) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine.

Molecular Properties

Compound Name4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine
PubChem CID103032155
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine
SMILESCOC(C)(C)CCC(N)C1CC1C
InChIInChI=1S/C11H23NO/c1-8-7-9(8)10(12)5-6-11(2,3)13-4/h8-10H,5-7,12H2,1-4H3
InChIKeyANHCPVVQJBIISJ-UHFFFAOYSA-N
XLogP2.17
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-bicyclo[2.2.1]heptanyl)-4-methoxy-4-methylpentan-1-amine
CID 103032021
4-methoxy-4-methyl-1-(2-phenylcyclopropyl)pentan-1-amine
CID 103031750
1-(3-ethylcyclopentyl)-4-methoxy-4-methylpentan-1-amine
CID 103035740
4-methoxy-4-methyl-1-(2,4,5-trimethyloxolan-3-yl)pentan-1-amine
CID 103032411
1-(1,4-dithian-2-yl)-4-methoxy-4-methylpentan-1-amine
CID 103035921
1-cyclohexyl-5-methoxy-5-methylhexan-2-amine
CID 103031159
1-(2-methylcyclopropyl)pent-4-yn-1-amine
CID 65422769
2,5-dimethoxy-2,5-dimethylhexane
CID 552009
1-(3,4-dihydro-2H-chromen-4-yl)-4-methoxy-4-methylpentan-1-amine
CID 103032406
1-(2-methylcyclopropyl)hex-5-en-1-amine
CID 65420400
1,1,1-trifluoro-6-methoxy-6-methylheptan-4-amine
CID 103027354
6-methoxy-3,6-dimethylheptan-1-amine
CID 103019673

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine?
The IUPAC name of 4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine (CID 103032155) is 4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine.
What is the SMILES notation for 4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine?
The canonical SMILES for 4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine is COC(C)(C)CCC(N)C1CC1C.
What is the InChIKey of 4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine?
The InChIKey is ANHCPVVQJBIISJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-8-7-9(8)10(12)5-6-11(2,3)13-4/h8-10H,5-7,12H2,1-4H3.
What are the key properties of 4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine?
4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine has a molecular weight of 185.31 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-4-methyl-1-(2-methylcyclopropyl)pentan-1-amine is sourced from PubChem (CID 103032155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).