(2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol

C16H18O — CID 116842745

IUPAC(2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol
SMILESCC1(C)CC1(CO)c1cccc2ccccc12
InChIInChI=1S/C16H18O/c1-15(2)10-16(15,11-17)14-9-5-7-12-6-3-4-8-13(12)14/h3-9,17H,10-11H2,1-2H3
InChIKeyZNJQRWZDCMTSHS-UHFFFAOYSA-N
MW226.32 g/mol
LogP3.50
Rot. Bonds2

About (2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol

(2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol (PubChem CID 116842745) has the molecular formula C16H18O and a molecular weight of 226.32 g/mol. Its IUPAC name is (2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol.

Molecular Properties

Compound Name(2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol
PubChem CID116842745
Molecular FormulaC16H18O
Molecular Weight226.32 g/mol
Exact Mass226.14
IUPAC Name(2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol
SMILESCC1(C)CC1(CO)c1cccc2ccccc12
InChIInChI=1S/C16H18O/c1-15(2)10-16(15,11-17)14-9-5-7-12-6-3-4-8-13(12)14/h3-9,17H,10-11H2,1-2H3
InChIKeyZNJQRWZDCMTSHS-UHFFFAOYSA-N
XLogP3.50
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol 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-1-naphthalen-1-ylcyclopentan-1-ol
CID 79863482
(1R)-2-(hydroxymethyl)-1-naphthalen-1-ylcyclopropane-1-carbonitrile
CID 66781211
[2,2-dimethyl-1-(2,3,4-trimethylphenyl)cyclopropyl]methanol
CID 116842736
2,4-dimethyl-2-naphthalen-1-ylmorpholine
CID 3066055
2,2,3-trimethyl-3-naphthalen-1-ylcyclopropane-1-carboxylic acid
CID 114229341
N-methyl-1-(2-methyl-2-naphthalen-1-ylcyclopropyl)methanamine
CID 62704010
3-methyl-3-naphthalen-1-ylcyclopentan-1-amine
CID 116538934
(1-naphthalen-1-ylcyclohexa-2,4-dien-1-yl)methanol
CID 175313272
3-naphthalen-1-yloxetan-3-ol
CID 116873048
3,4-dimethyl-1-naphthalen-1-ylcyclohexan-1-ol
CID 64746265
12-naphthalen-1-ylhexacyclo[11.7.1.13,7.02,12.017,21.011,22]docosa-1(20),3,5,7(22),8,10,13,15,17(21),18-decaen-2-ol
CID 11166060
2-tert-butyl-1-naphthalen-1-ylcyclohexan-1-amine
CID 63407963

Frequently Asked Questions

What is the IUPAC name of (2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol?
The IUPAC name of (2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol (CID 116842745) is (2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol.
What is the SMILES notation for (2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol?
The canonical SMILES for (2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol is CC1(C)CC1(CO)c1cccc2ccccc12.
What is the InChIKey of (2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol?
The InChIKey is ZNJQRWZDCMTSHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O/c1-15(2)10-16(15,11-17)14-9-5-7-12-6-3-4-8-13(12)14/h3-9,17H,10-11H2,1-2H3.
What are the key properties of (2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol?
(2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol has a molecular weight of 226.32 g/mol, XLogP of 3.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dimethyl-1-naphthalen-1-ylcyclopropyl)methanol is sourced from PubChem (CID 116842745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).