4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol

C17H21NO — CID 116941899

IUPAC4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol
SMILESNC(c1ccc2ccccc2c1)C1CCC(O)CC1
InChIInChI=1S/C17H21NO/c18-17(13-7-9-16(19)10-8-13)15-6-5-12-3-1-2-4-14(12)11-15/h1-6,11,13,16-17,19H,7-10,18H2
InChIKeyYSZDQJLGMATHHC-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.39
Rot. Bonds2

About 4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol

4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol (PubChem CID 116941899) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol
PubChem CID116941899
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol
SMILESNC(c1ccc2ccccc2c1)C1CCC(O)CC1
InChIInChI=1S/C17H21NO/c18-17(13-7-9-16(19)10-8-13)15-6-5-12-3-1-2-4-14(12)11-15/h1-6,11,13,16-17,19H,7-10,18H2
InChIKeyYSZDQJLGMATHHC-UHFFFAOYSA-N
XLogP3.39
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

cyclohexyl(naphthalen-2-yl)methanamine
CID 62715199
cyclopropyl(naphthalen-2-yl)methanol
CID 62791150
(R)-naphthalen-2-yl(oxan-4-yl)methanamine
CID 171246771
(R)-naphthalen-2-yl(oxan-4-yl)methanamine;hydrochloride
CID 171246772
(3,4-dimethylcyclohexyl)-naphthalen-2-ylmethanamine
CID 64738648
cyclopentyl(naphthalen-2-yl)methanol
CID 62715022
4-[amino-(4-methylphenyl)methyl]cyclohexan-1-ol
CID 116941804
4-[amino(naphthalen-1-yl)methyl]cyclohexan-1-ol
CID 116941898
3-bicyclo[3.1.0]hexanyl(naphthalen-2-yl)methanol
CID 115792754
4-[amino-(2-methyl-1,3-benzoxazol-5-yl)methyl]cyclohexan-1-ol
CID 116941871
cyclopropyl(quinolin-6-yl)methanamine
CID 55273103
(3-methyloxolan-2-yl)-naphthalen-2-ylmethanamine
CID 115851127

Frequently Asked Questions

What is the IUPAC name of 4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol?
The IUPAC name of 4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol (CID 116941899) is 4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol?
The canonical SMILES for 4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol is NC(c1ccc2ccccc2c1)C1CCC(O)CC1.
What is the InChIKey of 4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol?
The InChIKey is YSZDQJLGMATHHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c18-17(13-7-9-16(19)10-8-13)15-6-5-12-3-1-2-4-14(12)11-15/h1-6,11,13,16-17,19H,7-10,18H2.
What are the key properties of 4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol?
4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol has a molecular weight of 255.36 g/mol, XLogP of 3.39, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[amino(naphthalen-2-yl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 116941899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).