2-methyl-1-(naphthalen-1-ylamino)propan-2-ol

C14H17NO — CID 60884850

IUPAC2-methyl-1-(naphthalen-1-ylamino)propan-2-ol
SMILESCC(C)(O)CNc1cccc2ccccc12
InChIInChI=1S/C14H17NO/c1-14(2,16)10-15-13-9-5-7-11-6-3-4-8-12(11)13/h3-9,15-16H,10H2,1-2H3
InChIKeyDIFGUTFBTCPSNI-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.02
Rot. Bonds3

About 2-methyl-1-(naphthalen-1-ylamino)propan-2-ol

2-methyl-1-(naphthalen-1-ylamino)propan-2-ol (PubChem CID 60884850) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 2-methyl-1-(naphthalen-1-ylamino)propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-(naphthalen-1-ylamino)propan-2-ol
PubChem CID60884850
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name2-methyl-1-(naphthalen-1-ylamino)propan-2-ol
SMILESCC(C)(O)CNc1cccc2ccccc12
InChIInChI=1S/C14H17NO/c1-14(2,16)10-15-13-9-5-7-11-6-3-4-8-12(11)13/h3-9,15-16H,10H2,1-2H3
InChIKeyDIFGUTFBTCPSNI-UHFFFAOYSA-N
XLogP3.02
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-methyl-1-(naphthalen-1-ylamino)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

2,2-dimethyl-3-(naphthalen-1-ylamino)propanoic acid
CID 79629217
2,2-dimethyl-3-(naphthalen-1-ylamino)propanenitrile
CID 115233857
N,N'-dinaphthalen-1-ylethane-1,2-diamine;dihydrochloride
CID 69046784
2-methyl-1-(2-propan-2-ylanilino)propan-2-ol
CID 39241882
1-(2-fluoro-3-methylanilino)-2-methylpropan-2-ol
CID 130497270
2-methyl-1-(2-naphthalen-1-ylethylamino)propan-2-ol
CID 115137096
N-(2-hydroxy-2-methylpropyl)-2-naphthalen-1-ylacetamide
CID 65110602
2-(3,3-dimethyl-2-oxobutyl)sulfanyl-N-naphthalen-1-ylacetamide
CID 9457130
1-(2,3-dihydroxy-2-methylpropyl)-3-naphthalen-1-ylurea
CID 66170746
azane;N-naphthalen-1-ylhydroxylamine
CID 146318651
2-methyl-1-(2-propan-2-yloxyanilino)propan-2-ol
CID 39246107
1-ethyl-1-(2-hydroxy-2-methylpropyl)-3-naphthalen-1-ylurea
CID 79378172

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(naphthalen-1-ylamino)propan-2-ol?
The IUPAC name of 2-methyl-1-(naphthalen-1-ylamino)propan-2-ol (CID 60884850) is 2-methyl-1-(naphthalen-1-ylamino)propan-2-ol.
What is the SMILES notation for 2-methyl-1-(naphthalen-1-ylamino)propan-2-ol?
The canonical SMILES for 2-methyl-1-(naphthalen-1-ylamino)propan-2-ol is CC(C)(O)CNc1cccc2ccccc12.
What is the InChIKey of 2-methyl-1-(naphthalen-1-ylamino)propan-2-ol?
The InChIKey is DIFGUTFBTCPSNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-14(2,16)10-15-13-9-5-7-11-6-3-4-8-12(11)13/h3-9,15-16H,10H2,1-2H3.
What are the key properties of 2-methyl-1-(naphthalen-1-ylamino)propan-2-ol?
2-methyl-1-(naphthalen-1-ylamino)propan-2-ol has a molecular weight of 215.30 g/mol, XLogP of 3.02, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(naphthalen-1-ylamino)propan-2-ol is sourced from PubChem (CID 60884850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).