2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine

C15H20N2 — CID 113407203

IUPAC2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine
SMILESCC(CN)NCCc1ccc2ccccc2c1
InChIInChI=1S/C15H20N2/c1-12(11-16)17-9-8-13-6-7-14-4-2-3-5-15(14)10-13/h2-7,10,12,17H,8-9,11,16H2,1H3
InChIKeyFDTJHUOUBOVRBT-UHFFFAOYSA-N
MW228.34 g/mol
LogP2.32
Rot. Bonds5

About 2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine

2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine (PubChem CID 113407203) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine.

Molecular Properties

Compound Name2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine
PubChem CID113407203
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine
SMILESCC(CN)NCCc1ccc2ccccc2c1
InChIInChI=1S/C15H20N2/c1-12(11-16)17-9-8-13-6-7-14-4-2-3-5-15(14)10-13/h2-7,10,12,17H,8-9,11,16H2,1H3
InChIKeyFDTJHUOUBOVRBT-UHFFFAOYSA-N
XLogP2.32
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(2-naphthalen-2-ylethyl)propanamide
CID 115152538
2-methyl-N-(2-naphthalen-2-ylethyl)propanamide
CID 118336690
(2R)-4-naphthalen-2-ylbutan-2-amine
CID 131577314
N-(1-naphthalen-2-ylpropan-2-yl)butan-1-amine
CID 82262424
2-N-methyl-2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine
CID 117040198
(2R)-2-N-[2-[4-(trifluoromethyl)phenyl]ethyl]propane-1,2-diamine
CID 104868043
4-amino-3-methoxy-N-(2-naphthalen-2-ylethyl)butanamide;hydrochloride
CID 120589267
2-(3-iodobutyl)naphthalene
CID 162353144
N-(2-naphthalen-2-ylethyl)formamide
CID 12581518
3-methyl-N-(naphthalen-2-ylmethyl)butan-2-amine
CID 43085087
1-methylsulfanyl-N-(naphthalen-2-ylmethyl)propan-2-amine
CID 113239115
(2S)-3-naphthalen-2-ylpropane-1,2-diamine
CID 68655255

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine?
The IUPAC name of 2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine (CID 113407203) is 2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine.
What is the SMILES notation for 2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine?
The canonical SMILES for 2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine is CC(CN)NCCc1ccc2ccccc2c1.
What is the InChIKey of 2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine?
The InChIKey is FDTJHUOUBOVRBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-12(11-16)17-9-8-13-6-7-14-4-2-3-5-15(14)10-13/h2-7,10,12,17H,8-9,11,16H2,1H3.
What are the key properties of 2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine?
2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine has a molecular weight of 228.34 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-naphthalen-2-ylethyl)propane-1,2-diamine is sourced from PubChem (CID 113407203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).