1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine

C19H25NO — CID 105156579

IUPAC1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine
SMILESNC(CCCC1CCCO1)Cc1cccc2ccccc12
InChIInChI=1S/C19H25NO/c20-17(9-4-10-18-11-5-13-21-18)14-16-8-3-7-15-6-1-2-12-19(15)16/h1-3,6-8,12,17-18H,4-5,9-11,13-14,20H2
InChIKeyBRXJECFRHQHAHG-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.06
Rot. Bonds6

About 1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine

1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine (PubChem CID 105156579) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine.

Molecular Properties

Compound Name1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine
PubChem CID105156579
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC Name1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine
SMILESNC(CCCC1CCCO1)Cc1cccc2ccccc12
InChIInChI=1S/C19H25NO/c20-17(9-4-10-18-11-5-13-21-18)14-16-8-3-7-15-6-1-2-12-19(15)16/h1-3,6-8,12,17-18H,4-5,9-11,13-14,20H2
InChIKeyBRXJECFRHQHAHG-UHFFFAOYSA-N
XLogP4.06
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chlorophenyl)-5-(oxolan-2-yl)pentan-2-amine
CID 65164797
1-(2-fluorophenyl)-4-(oxolan-2-yl)butan-2-amine
CID 65164593
5-(oxolan-2-yl)-1-pyridin-4-ylpentan-2-amine
CID 65164603
1-(2-methylphenyl)-4-(oxan-2-yl)butan-2-amine
CID 63951754
1-(3,5-dimethylphenyl)-5-(oxolan-2-yl)pentan-2-amine
CID 65164754
1-(2-chlorophenyl)sulfanyl-5-(oxolan-2-yl)pentan-2-amine
CID 66141385
ethyl 2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propanoate
CID 170452725
1-(furan-2-yl)-4-(oxolan-2-yl)butan-2-amine
CID 105029349
1-(2,3-difluorophenyl)-5-(oxolan-2-yl)pentan-2-ol
CID 115808969
1-N-[2-(oxolan-2-yl)ethyl]-4-phenylbutane-1,2-diamine
CID 114929660
1-(3-chlorophenoxy)-5-(oxolan-2-yl)pentan-2-amine
CID 105156521
1-(2-fluoro-3-methoxyphenyl)-4-(oxan-2-yl)butan-2-amine
CID 105035512

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine?
The IUPAC name of 1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine (CID 105156579) is 1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine.
What is the SMILES notation for 1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine?
The canonical SMILES for 1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine is NC(CCCC1CCCO1)Cc1cccc2ccccc12.
What is the InChIKey of 1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine?
The InChIKey is BRXJECFRHQHAHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c20-17(9-4-10-18-11-5-13-21-18)14-16-8-3-7-15-6-1-2-12-19(15)16/h1-3,6-8,12,17-18H,4-5,9-11,13-14,20H2.
What are the key properties of 1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine?
1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine has a molecular weight of 283.42 g/mol, XLogP of 4.06, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-yl-5-(oxolan-2-yl)pentan-2-amine is sourced from PubChem (CID 105156579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).