N-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine

C19H25NO — CID 65332373

IUPACN-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine
SMILESCCCNC(c1ccc2ccccc2c1)C1CCCOC1
InChIInChI=1S/C19H25NO/c1-2-11-20-19(18-8-5-12-21-14-18)17-10-9-15-6-3-4-7-16(15)13-17/h3-4,6-7,9-10,13,18-20H,2,5,8,11-12,14H2,1H3
InChIKeyWBOHGSVUYPFDRT-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.31
Rot. Bonds5

About N-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine

N-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine (PubChem CID 65332373) has the molecular formula C19H25NO and a molecular weight of 283.42 g/mol. Its IUPAC name is N-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine
PubChem CID65332373
Molecular FormulaC19H25NO
Molecular Weight283.42 g/mol
Exact Mass283.19
IUPAC NameN-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine
SMILESCCCNC(c1ccc2ccccc2c1)C1CCCOC1
InChIInChI=1S/C19H25NO/c1-2-11-20-19(18-8-5-12-21-14-18)17-10-9-15-6-3-4-7-16(15)13-17/h3-4,6-7,9-10,13,18-20H,2,5,8,11-12,14H2,1H3
InChIKeyWBOHGSVUYPFDRT-UHFFFAOYSA-N
XLogP4.31
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[cyclopentyl(naphthalen-2-yl)methyl]propan-1-amine
CID 63416906
N-[(4-chloro-3-fluorophenyl)-(oxan-3-yl)methyl]propan-1-amine
CID 107996097
N-[oxan-3-yl(quinoxalin-6-yl)methyl]propan-1-amine
CID 107136382
N-[[3-(difluoromethoxy)phenyl]-(oxan-3-yl)methyl]propan-1-amine
CID 107139119
N-[(4-methylsulfanylphenyl)-(oxan-3-yl)methyl]propan-1-amine
CID 107137025
N-[oxolan-3-yl(quinolin-3-yl)methyl]propan-1-amine
CID 65330638
N-[(2-ethylphenyl)-(oxan-3-yl)methyl]propan-1-amine
CID 107139020
N-[oxan-3-yl(quinolin-6-yl)methyl]ethanamine
CID 81231200
N-[[4-(2-methoxyethyl)phenyl]-(oxan-3-yl)methyl]propan-1-amine
CID 63012897
N-[cycloheptyl(naphthalen-2-yl)methyl]ethanamine
CID 65399024
N-[(3-cyclobutylphenyl)-(oxolan-3-yl)methyl]propan-1-amine
CID 114603372
N-[(5-methylfuran-2-yl)-(oxan-3-yl)methyl]propan-1-amine
CID 63013091

Frequently Asked Questions

What is the IUPAC name of N-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine?
The IUPAC name of N-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine (CID 65332373) is N-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine.
What is the SMILES notation for N-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine?
The canonical SMILES for N-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine is CCCNC(c1ccc2ccccc2c1)C1CCCOC1.
What is the InChIKey of N-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine?
The InChIKey is WBOHGSVUYPFDRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO/c1-2-11-20-19(18-8-5-12-21-14-18)17-10-9-15-6-3-4-7-16(15)13-17/h3-4,6-7,9-10,13,18-20H,2,5,8,11-12,14H2,1H3.
What are the key properties of N-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine?
N-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine has a molecular weight of 283.42 g/mol, XLogP of 4.31, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[naphthalen-2-yl(oxan-3-yl)methyl]propan-1-amine is sourced from PubChem (CID 65332373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).