N-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine

C18H24N2 — CID 106603263

IUPACN-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine
SMILESCCN(Cc1cccc2ccccc12)CC1CCCN1
InChIInChI=1S/C18H24N2/c1-2-20(14-17-10-6-12-19-17)13-16-9-5-8-15-7-3-4-11-18(15)16/h3-5,7-9,11,17,19H,2,6,10,12-14H2,1H3
InChIKeyFLITWQAIDZAYLN-UHFFFAOYSA-N
MW268.40 g/mol
LogP3.41
Rot. Bonds5

About N-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine

N-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine (PubChem CID 106603263) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine
PubChem CID106603263
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC NameN-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine
SMILESCCN(Cc1cccc2ccccc12)CC1CCCN1
InChIInChI=1S/C18H24N2/c1-2-20(14-17-10-6-12-19-17)13-16-9-5-8-15-7-3-4-11-18(15)16/h3-5,7-9,11,17,19H,2,6,10,12-14H2,1H3
InChIKeyFLITWQAIDZAYLN-UHFFFAOYSA-N
XLogP3.41
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(methoxymethyl)phenyl]methyl]-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 106603473
N-(pyrrolidin-2-ylmethyl)-N-[[2-(trifluoromethyl)phenyl]methyl]ethanamine
CID 106603566
2-[[ethyl(pyrrolidin-2-ylmethyl)amino]methyl]benzamide
CID 106615202
N-(piperidin-2-ylmethyl)-N-[[2-(trifluoromethyl)phenyl]methyl]ethanamine
CID 106622610
N-benzyl-N-(piperidin-2-ylmethyl)ethanamine;dihydrochloride
CID 56831759
N-[(2-fluoro-3-methoxyphenyl)methyl]-N-(piperidin-2-ylmethyl)ethanamine
CID 106632656
1-cyclopropyl-N-[(2-ethylphenyl)methyl]-N-(pyrrolidin-2-ylmethyl)methanamine
CID 106604438
N-[(2,5-dimethylphenyl)methyl]-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 106603290
N-ethyl-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 4715267
N-(pyridin-4-ylmethyl)-N-[[(2R)-pyrrolidin-2-yl]methyl]ethanamine
CID 102819441
N-ethyl-N-[[(2S)-piperidin-2-yl]methyl]ethanamine
CID 6999827
1-cyclopropyl-N-[(2-cyclopropylphenyl)methyl]-N-(pyrrolidin-2-ylmethyl)methanamine
CID 106604598

Frequently Asked Questions

What is the IUPAC name of N-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine?
The IUPAC name of N-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine (CID 106603263) is N-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine.
What is the SMILES notation for N-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine?
The canonical SMILES for N-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine is CCN(Cc1cccc2ccccc12)CC1CCCN1.
What is the InChIKey of N-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine?
The InChIKey is FLITWQAIDZAYLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-2-20(14-17-10-6-12-19-17)13-16-9-5-8-15-7-3-4-11-18(15)16/h3-5,7-9,11,17,19H,2,6,10,12-14H2,1H3.
What are the key properties of N-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine?
N-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine has a molecular weight of 268.40 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(naphthalen-1-ylmethyl)-N-(pyrrolidin-2-ylmethyl)ethanamine is sourced from PubChem (CID 106603263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).