(2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol

C15H19NO — CID 103934919

IUPAC(2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol
SMILESCCN(C[C@H](C)O)c1cccc2ccccc12
InChIInChI=1S/C15H19NO/c1-3-16(11-12(2)17)15-10-6-8-13-7-4-5-9-14(13)15/h4-10,12,17H,3,11H2,1-2H3/t12-/m0/s1
InChIKeyAXRGFGCGOCDVIS-LBPRGKRZSA-N
MW229.32 g/mol
LogP3.05
Rot. Bonds4

About (2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol

(2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol (PubChem CID 103934919) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is (2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol.

Molecular Properties

Compound Name(2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol
PubChem CID103934919
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name(2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol
SMILESCCN(C[C@H](C)O)c1cccc2ccccc12
InChIInChI=1S/C15H19NO/c1-3-16(11-12(2)17)15-10-6-8-13-7-4-5-9-14(13)15/h4-10,12,17H,3,11H2,1-2H3/t12-/m0/s1
InChIKeyAXRGFGCGOCDVIS-LBPRGKRZSA-N
XLogP3.05
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-bromo-2-methylpropyl)-N-ethylnaphthalen-1-amine
CID 64996339
1-[ethyl(naphthalen-1-yl)amino]-3-(methylamino)propan-2-ol
CID 43187919
1-N-ethyl-1-N-naphthalen-1-ylbutane-1,2-diamine
CID 43649715
1-N-ethyl-4-methyl-1-N-naphthalen-1-ylpentane-1,2-diamine
CID 43095261
1-N-ethyl-2-N,3,3-trimethyl-1-N-naphthalen-1-ylbutane-1,2-diamine
CID 63467287
N,N,N'-triethyl-N'-naphthalen-1-ylethane-1,2-diamine
CID 3028375
N,N-dimethylnaphthalen-1-amine;hydroxylamine
CID 135773162
1-(N-ethyl-2-nitroanilino)propan-2-ol
CID 139729863
3-[ethyl(naphthalen-1-yl)amino]-2,2-dimethylpropan-1-ol
CID 62271078
N'-ethyl-N'-naphthalen-1-yl-N-propan-2-ylbutane-1,4-diamine
CID 60851673
N'-ethyl-N-(2-methylpropyl)-N'-naphthalen-1-ylpropane-1,3-diamine
CID 63467286
potassium 3-[ethyl(naphthalen-1-yl)amino]prop-1-en-2-yl-trifluoroboranuide
CID 106745593

Frequently Asked Questions

What is the IUPAC name of (2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol?
The IUPAC name of (2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol (CID 103934919) is (2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol.
What is the SMILES notation for (2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol?
The canonical SMILES for (2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol is CCN(C[C@H](C)O)c1cccc2ccccc12.
What is the InChIKey of (2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol?
The InChIKey is AXRGFGCGOCDVIS-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H19NO/c1-3-16(11-12(2)17)15-10-6-8-13-7-4-5-9-14(13)15/h4-10,12,17H,3,11H2,1-2H3/t12-/m0/s1.
What are the key properties of (2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol?
(2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol has a molecular weight of 229.32 g/mol, XLogP of 3.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-[ethyl(naphthalen-1-yl)amino]propan-2-ol is sourced from PubChem (CID 103934919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).