N-(2-methoxypropyl)-1-phenylpentan-1-amine

C15H25NO — CID 102696616

IUPACN-(2-methoxypropyl)-1-phenylpentan-1-amine
SMILESCCCCC(NCC(C)OC)c1ccccc1
InChIInChI=1S/C15H25NO/c1-4-5-11-15(16-12-13(2)17-3)14-9-7-6-8-10-14/h6-10,13,15-16H,4-5,11-12H2,1-3H3
InChIKeySPSAKVDTHLMZFS-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.54
Rot. Bonds8

About N-(2-methoxypropyl)-1-phenylpentan-1-amine

N-(2-methoxypropyl)-1-phenylpentan-1-amine (PubChem CID 102696616) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is N-(2-methoxypropyl)-1-phenylpentan-1-amine.

Molecular Properties

Compound NameN-(2-methoxypropyl)-1-phenylpentan-1-amine
PubChem CID102696616
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC NameN-(2-methoxypropyl)-1-phenylpentan-1-amine
SMILESCCCCC(NCC(C)OC)c1ccccc1
InChIInChI=1S/C15H25NO/c1-4-5-11-15(16-12-13(2)17-3)14-9-7-6-8-10-14/h6-10,13,15-16H,4-5,11-12H2,1-3H3
InChIKeySPSAKVDTHLMZFS-UHFFFAOYSA-N
XLogP3.54
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-methyl-3-methylsulfanylpropyl)-1-phenylpentan-1-amine
CID 63983409
1-phenyl-N-(2-pyrrolidin-1-ylpropyl)pentan-1-amine
CID 79139729
N-(1-phenylpentyl)heptan-1-amine
CID 10084030
3-methyl-4-(1-phenylhexylamino)butan-1-ol
CID 66091324
(1S)-N-methyl-1-phenylpentan-1-amine
CID 86314170
N-(2,2-dimethylpropyl)-1-phenylpentan-1-amine
CID 55191412
N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1-phenylpentan-1-amine
CID 63463886
[(1S)-1-phenylpentyl]hydrazine
CID 124537681
3-(1-phenylhexylamino)propane-1,2-diol
CID 66176548
N-(1-phenylpentyl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 43757523
N-methoxy-1-phenylhexan-1-amine
CID 82707077
2,4-dimethyl-N-(1-phenylpentyl)pentan-3-amine
CID 10659103

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxypropyl)-1-phenylpentan-1-amine?
The IUPAC name of N-(2-methoxypropyl)-1-phenylpentan-1-amine (CID 102696616) is N-(2-methoxypropyl)-1-phenylpentan-1-amine.
What is the SMILES notation for N-(2-methoxypropyl)-1-phenylpentan-1-amine?
The canonical SMILES for N-(2-methoxypropyl)-1-phenylpentan-1-amine is CCCCC(NCC(C)OC)c1ccccc1.
What is the InChIKey of N-(2-methoxypropyl)-1-phenylpentan-1-amine?
The InChIKey is SPSAKVDTHLMZFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c1-4-5-11-15(16-12-13(2)17-3)14-9-7-6-8-10-14/h6-10,13,15-16H,4-5,11-12H2,1-3H3.
What are the key properties of N-(2-methoxypropyl)-1-phenylpentan-1-amine?
N-(2-methoxypropyl)-1-phenylpentan-1-amine has a molecular weight of 235.37 g/mol, XLogP of 3.54, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxypropyl)-1-phenylpentan-1-amine is sourced from PubChem (CID 102696616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).