1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol

C17H21NO — CID 66040349

IUPAC1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol
SMILESCC(O)(CNC1CC1)Cc1cccc2ccccc12
InChIInChI=1S/C17H21NO/c1-17(19,12-18-15-9-10-15)11-14-7-4-6-13-5-2-3-8-16(13)14/h2-8,15,18-19H,9-12H2,1H3
InChIKeyQEVFFEVKBBTAMX-UHFFFAOYSA-N
MW255.36 g/mol
LogP2.89
Rot. Bonds5

About 1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol

1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol (PubChem CID 66040349) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol.

Molecular Properties

Compound Name1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol
PubChem CID66040349
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol
SMILESCC(O)(CNC1CC1)Cc1cccc2ccccc12
InChIInChI=1S/C17H21NO/c1-17(19,12-18-15-9-10-15)11-14-7-4-6-13-5-2-3-8-16(13)14/h2-8,15,18-19H,9-12H2,1H3
InChIKeyQEVFFEVKBBTAMX-UHFFFAOYSA-N
XLogP2.89
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-methyl-2-(naphthalen-1-ylmethyl)butyl]cyclopropanamine
CID 63509358
N-[2-ethyl-2-(naphthalen-1-ylmethyl)butyl]cyclopropanamine
CID 63509675
2,2,2-trifluoro-N-(2-hydroxy-2-methyl-3-naphthalen-1-ylpropyl)acetamide
CID 87160915
2-cyclohexyl-1-naphthalen-1-ylpropan-2-ol
CID 114795042
1-(1-bromonaphthalen-2-yl)oxy-3-(cyclopropylamino)-2-methylpropan-2-ol
CID 66335499
N-(2,2-dimethyl-3-phenylpropyl)cyclopropanamine
CID 62724545
1-(cyclopropylamino)-3-(4-methoxyphenyl)-2-methylpropan-2-ol
CID 63270705
1-(cyclopropylamino)-3-(2-ethylphenoxy)-2-methylpropan-2-ol
CID 66336099
2-methyl-1-[(4-phenylcyclohexyl)amino]pentan-2-ol
CID 103783342
1-(2,2-dimethylpropyl)naphthalene;methane
CID 145304916
4-(2-naphthalen-1-ylethylamino)cyclohexane-1-carboxylic acid
CID 122031153
1-(2-methyl-2-phenylpropyl)naphthalene
CID 86035126

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol?
The IUPAC name of 1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol (CID 66040349) is 1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol.
What is the SMILES notation for 1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol?
The canonical SMILES for 1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol is CC(O)(CNC1CC1)Cc1cccc2ccccc12.
What is the InChIKey of 1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol?
The InChIKey is QEVFFEVKBBTAMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-17(19,12-18-15-9-10-15)11-14-7-4-6-13-5-2-3-8-16(13)14/h2-8,15,18-19H,9-12H2,1H3.
What are the key properties of 1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol?
1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol has a molecular weight of 255.36 g/mol, XLogP of 2.89, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-2-methyl-3-naphthalen-1-ylpropan-2-ol is sourced from PubChem (CID 66040349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).