N-(1-naphthalen-2-ylethyl)pentan-3-amine

C17H23N — CID 43100971

IUPACN-(1-naphthalen-2-ylethyl)pentan-3-amine
SMILESCCC(CC)NC(C)c1ccc2ccccc2c1
InChIInChI=1S/C17H23N/c1-4-17(5-2)18-13(3)15-11-10-14-8-6-7-9-16(14)12-15/h6-13,17-18H,4-5H2,1-3H3
InChIKeySBHHKYFRHWWURN-UHFFFAOYSA-N
MW241.38 g/mol
LogP4.68
Rot. Bonds5

About N-(1-naphthalen-2-ylethyl)pentan-3-amine

N-(1-naphthalen-2-ylethyl)pentan-3-amine (PubChem CID 43100971) has the molecular formula C17H23N and a molecular weight of 241.38 g/mol. Its IUPAC name is N-(1-naphthalen-2-ylethyl)pentan-3-amine.

Molecular Properties

Compound NameN-(1-naphthalen-2-ylethyl)pentan-3-amine
PubChem CID43100971
Molecular FormulaC17H23N
Molecular Weight241.38 g/mol
Exact Mass241.18
IUPAC NameN-(1-naphthalen-2-ylethyl)pentan-3-amine
SMILESCCC(CC)NC(C)c1ccc2ccccc2c1
InChIInChI=1S/C17H23N/c1-4-17(5-2)18-13(3)15-11-10-14-8-6-7-9-16(14)12-15/h6-13,17-18H,4-5H2,1-3H3
InChIKeySBHHKYFRHWWURN-UHFFFAOYSA-N
XLogP4.68
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(1-naphthalen-2-ylethylamino)butan-1-ol
CID 43207106
4-methyl-N-(1-naphthalen-2-ylethyl)pentan-2-amine
CID 43371937
N-(1-naphthalen-2-ylethyl)-1-phenylethanamine
CID 22011039
5-methyl-N-(1-naphthalen-2-ylethyl)hexan-2-amine
CID 43094860
1-methoxy-N-(1-naphthalen-2-ylethyl)propan-2-amine
CID 43191837
N-[(1R)-1-phenylethyl]pentan-3-amine;hydrochloride
CID 22831493
1-naphthalen-2-yl-N-[(1R)-1-naphthalen-1-ylethyl]ethanamine
CID 57253252
2-[(1-naphthalen-2-ylethylamino)methyl]phenol
CID 115602905
1-naphthalen-2-ylethanamine
CID 3857145
(1R)-N-[(1S)-1-phenanthren-2-ylethyl]-1-phenylethanamine
CID 102238252
N-(1-naphthalen-2-ylethyl)but-2-yn-1-amine
CID 113341996
N-[(1R)-1-naphthalen-2-ylethyl]octan-1-amine
CID 166642930

Frequently Asked Questions

What is the IUPAC name of N-(1-naphthalen-2-ylethyl)pentan-3-amine?
The IUPAC name of N-(1-naphthalen-2-ylethyl)pentan-3-amine (CID 43100971) is N-(1-naphthalen-2-ylethyl)pentan-3-amine.
What is the SMILES notation for N-(1-naphthalen-2-ylethyl)pentan-3-amine?
The canonical SMILES for N-(1-naphthalen-2-ylethyl)pentan-3-amine is CCC(CC)NC(C)c1ccc2ccccc2c1.
What is the InChIKey of N-(1-naphthalen-2-ylethyl)pentan-3-amine?
The InChIKey is SBHHKYFRHWWURN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N/c1-4-17(5-2)18-13(3)15-11-10-14-8-6-7-9-16(14)12-15/h6-13,17-18H,4-5H2,1-3H3.
What are the key properties of N-(1-naphthalen-2-ylethyl)pentan-3-amine?
N-(1-naphthalen-2-ylethyl)pentan-3-amine has a molecular weight of 241.38 g/mol, XLogP of 4.68, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-naphthalen-2-ylethyl)pentan-3-amine is sourced from PubChem (CID 43100971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).