3-naphthalen-2-yl-N-propylbutan-2-amine

C17H23N — CID 66437220

IUPAC3-naphthalen-2-yl-N-propylbutan-2-amine
SMILESCCCNC(C)C(C)c1ccc2ccccc2c1
InChIInChI=1S/C17H23N/c1-4-11-18-14(3)13(2)16-10-9-15-7-5-6-8-17(15)12-16/h5-10,12-14,18H,4,11H2,1-3H3
InChIKeyHAQATDUXQDBWHU-UHFFFAOYSA-N
MW241.38 g/mol
LogP4.33
Rot. Bonds5

About 3-naphthalen-2-yl-N-propylbutan-2-amine

3-naphthalen-2-yl-N-propylbutan-2-amine (PubChem CID 66437220) has the molecular formula C17H23N and a molecular weight of 241.38 g/mol. Its IUPAC name is 3-naphthalen-2-yl-N-propylbutan-2-amine.

Molecular Properties

Compound Name3-naphthalen-2-yl-N-propylbutan-2-amine
PubChem CID66437220
Molecular FormulaC17H23N
Molecular Weight241.38 g/mol
Exact Mass241.18
IUPAC Name3-naphthalen-2-yl-N-propylbutan-2-amine
SMILESCCCNC(C)C(C)c1ccc2ccccc2c1
InChIInChI=1S/C17H23N/c1-4-11-18-14(3)13(2)16-10-9-15-7-5-6-8-17(15)12-16/h5-10,12-14,18H,4,11H2,1-3H3
InChIKeyHAQATDUXQDBWHU-UHFFFAOYSA-N
XLogP4.33
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 ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2-dimethyl-1-naphthalen-2-yl-N-propylpropan-1-amine
CID 63413588
2-naphthalen-2-yl-2-(propylamino)ethanol
CID 61055183
2-methoxy-1-naphthalen-2-yl-N-propylpropan-1-amine
CID 79616716
2-naphthalen-2-yl-2-(propylamino)acetic acid
CID 43754123
N-[naphthalen-2-yl(pyrimidin-2-yl)methyl]propan-1-amine
CID 62790717
2,2-dimethyl-1-naphthalen-2-yl-N-propylbutan-1-amine
CID 115851112
3-naphthalen-2-yl-3-(propylamino)propan-1-ol
CID 64814482
N-[(1R)-1-naphthalen-2-ylethyl]octan-1-amine
CID 166642930
1-naphthalen-2-ylsulfanyl-N-propylpropan-2-amine
CID 64648859
N-[naphthalen-2-yl(pyridin-2-yl)methyl]propan-1-amine
CID 62790514
2-methoxy-2-methyl-1-naphthalen-2-yl-N-propylpropan-1-amine
CID 79196999
N-[cyclopentyl(naphthalen-2-yl)methyl]propan-1-amine
CID 63416906

Frequently Asked Questions

What is the IUPAC name of 3-naphthalen-2-yl-N-propylbutan-2-amine?
The IUPAC name of 3-naphthalen-2-yl-N-propylbutan-2-amine (CID 66437220) is 3-naphthalen-2-yl-N-propylbutan-2-amine.
What is the SMILES notation for 3-naphthalen-2-yl-N-propylbutan-2-amine?
The canonical SMILES for 3-naphthalen-2-yl-N-propylbutan-2-amine is CCCNC(C)C(C)c1ccc2ccccc2c1.
What is the InChIKey of 3-naphthalen-2-yl-N-propylbutan-2-amine?
The InChIKey is HAQATDUXQDBWHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N/c1-4-11-18-14(3)13(2)16-10-9-15-7-5-6-8-17(15)12-16/h5-10,12-14,18H,4,11H2,1-3H3.
What are the key properties of 3-naphthalen-2-yl-N-propylbutan-2-amine?
3-naphthalen-2-yl-N-propylbutan-2-amine has a molecular weight of 241.38 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-naphthalen-2-yl-N-propylbutan-2-amine is sourced from PubChem (CID 66437220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).