N-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine

C16H25NO — CID 65431144

IUPACN-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine
SMILESCNCC(CCCC1CCCO1)c1ccccc1
InChIInChI=1S/C16H25NO/c1-17-13-15(14-7-3-2-4-8-14)9-5-10-16-11-6-12-18-16/h2-4,7-8,15-17H,5-6,9-13H2,1H3
InChIKeyNSCFENZVEXILFT-UHFFFAOYSA-N
MW247.38 g/mol
LogP3.34
Rot. Bonds7

About N-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine

N-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine (PubChem CID 65431144) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is N-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine.

Molecular Properties

Compound NameN-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine
PubChem CID65431144
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC NameN-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine
SMILESCNCC(CCCC1CCCO1)c1ccccc1
InChIInChI=1S/C16H25NO/c1-17-13-15(14-7-3-2-4-8-14)9-5-10-16-11-6-12-18-16/h2-4,7-8,15-17H,5-6,9-13H2,1H3
InChIKeyNSCFENZVEXILFT-UHFFFAOYSA-N
XLogP3.34
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenyl)-5-(oxolan-2-yl)-N-propylpentan-1-amine
CID 79432124
6-(oxolan-2-yl)-2-phenylhexan-3-ol
CID 65162298
2-(2-methylphenyl)-5-(oxolan-2-yl)-N-propylpentan-1-amine
CID 79424185
N-ethyl-1-(oxolan-2-yl)-5-phenylheptan-4-amine
CID 104992984
1-methoxy-5-(oxolan-2-yl)-1-phenylpentan-2-ol
CID 116756915
2-[3-(oxolan-2-yl)propylamino]-1-phenylethanol
CID 65164044
N-methyl-2-(oxolan-2-ylmethylsulfonyl)-2-phenylethanamine
CID 106513586
1-ethoxy-5-(oxolan-2-yl)-1-phenylpentan-2-amine
CID 116773427
(1S)-N-[2-(oxolan-2-yl)ethyl]-1-phenylethanamine
CID 65163698
2-methyl-N-[3-(oxolan-2-yl)-2-phenylpropyl]propan-2-amine
CID 65431740
2-(3-chlorophenyl)-N-methyl-3-(oxolan-2-yl)propan-1-amine
CID 79443477
2-(7-phenyloctyl)oxetane
CID 173415617

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine?
The IUPAC name of N-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine (CID 65431144) is N-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine.
What is the SMILES notation for N-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine?
The canonical SMILES for N-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine is CNCC(CCCC1CCCO1)c1ccccc1.
What is the InChIKey of N-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine?
The InChIKey is NSCFENZVEXILFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-17-13-15(14-7-3-2-4-8-14)9-5-10-16-11-6-12-18-16/h2-4,7-8,15-17H,5-6,9-13H2,1H3.
What are the key properties of N-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine?
N-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine has a molecular weight of 247.38 g/mol, XLogP of 3.34, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(oxolan-2-yl)-2-phenylpentan-1-amine is sourced from PubChem (CID 65431144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).