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

C16H21NO — CID 106294557

IUPAC2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol
SMILESCCCC(C)(O)CNc1ccc2ccccc2c1
InChIInChI=1S/C16H21NO/c1-3-10-16(2,18)12-17-15-9-8-13-6-4-5-7-14(13)11-15/h4-9,11,17-18H,3,10,12H2,1-2H3
InChIKeyXKBUALJNJMSNER-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.80
Rot. Bonds5

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

2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol (PubChem CID 106294557) has the molecular formula C16H21NO and a molecular weight of 243.35 g/mol. Its IUPAC name is 2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol.

Molecular Properties

Compound Name2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol
PubChem CID106294557
Molecular FormulaC16H21NO
Molecular Weight243.35 g/mol
Exact Mass243.16
IUPAC Name2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol
SMILESCCCC(C)(O)CNc1ccc2ccccc2c1
InChIInChI=1S/C16H21NO/c1-3-10-16(2,18)12-17-15-9-8-13-6-4-5-7-14(13)11-15/h4-9,11,17-18H,3,10,12H2,1-2H3
InChIKeyXKBUALJNJMSNER-UHFFFAOYSA-N
XLogP3.80
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,2,3-trimethylbutyl)naphthalen-2-amine
CID 114100780
2,2-difluoro-3-(naphthalen-2-ylamino)propan-1-ol
CID 106177968
N-tert-butylnaphthalen-2-amine
CID 13200783
N-hexadecylnaphthalen-2-amine
CID 12796089
3-ethyl-1-(naphthalen-2-ylamino)pentan-2-ol
CID 106287465
1-(1-hydroxy-2-methylpentan-2-yl)-3-naphthalen-2-ylurea
CID 111925797
2-(naphthalen-2-ylamino)-N-propylacetamide
CID 43400801
2-(naphthalen-2-ylamino)acetonitrile
CID 43420244
3-(naphthalen-2-ylamino)-N-propylpropanamide
CID 62020504
2-methyl-1-[[5-(methylamino)-3-pyridinyl]amino]pentan-2-ol
CID 106296396
N-tert-butylanthracen-2-amine
CID 170102220
1-[(6-bromo-2-propan-2-ylpyrimidin-4-yl)amino]-2-methylpentan-2-ol
CID 114169544

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol?
The IUPAC name of 2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol (CID 106294557) is 2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol.
What is the SMILES notation for 2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol?
The canonical SMILES for 2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol is CCCC(C)(O)CNc1ccc2ccccc2c1.
What is the InChIKey of 2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol?
The InChIKey is XKBUALJNJMSNER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO/c1-3-10-16(2,18)12-17-15-9-8-13-6-4-5-7-14(13)11-15/h4-9,11,17-18H,3,10,12H2,1-2H3.
What are the key properties of 2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol?
2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol has a molecular weight of 243.35 g/mol, XLogP of 3.80, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(naphthalen-2-ylamino)pentan-2-ol is sourced from PubChem (CID 106294557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).