15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol

C17H25NO — CID 139492163

IUPAC15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol
SMILESCc1cc2c(cc1O)C1(C)CCCCCC(C2)C1N
InChIInChI=1S/C17H25NO/c1-11-8-13-9-12-6-4-3-5-7-17(2,16(12)18)14(13)10-15(11)19/h8,10,12,16,19H,3-7,9,18H2,1-2H3
InChIKeyOCGBACHWCXSEDC-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.42
Rot. Bonds

About 15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol

15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol (PubChem CID 139492163) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol.

Molecular Properties

Compound Name15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol
PubChem CID139492163
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol
SMILESCc1cc2c(cc1O)C1(C)CCCCCC(C2)C1N
InChIInChI=1S/C17H25NO/c1-11-8-13-9-12-6-4-3-5-7-17(2,16(12)18)14(13)10-15(11)19/h8,10,12,16,19H,3-7,9,18H2,1-2H3
InChIKeyOCGBACHWCXSEDC-UHFFFAOYSA-N
XLogP3.42
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol with MolForge

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Related Compounds

(1R,9R,15R)-15-amino-1-methyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol;hydrochloride
CID 71577923
[(1R,9S)-15-amino-1-methyl-4-tricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trienyl]methanol
CID 153437146
1-O-[(1R,9S,16S)-16-amino-1-methyl-4-tricyclo[7.6.1.02,7]hexadeca-2(7),3,5-trienyl] 6-O-[(1R,9S,15S)-15-amino-1-methyl-4-tricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trienyl] hexanedioate
CID 139492319
(1R,9S,15S)-4-(2-methoxypropan-2-yloxy)-1-methyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-15-amine
CID 138672478
15-amino-6-ethyl-1-methyltricyclo[7.5.1.02,7]pentadeca-2,4,6-trien-4-ol
CID 139492239
(1R,9S,15S)-1-methyl-4-(propan-2-yloxymethoxy)tricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-15-amine
CID 138672240
(1R,9S,16S)-1-methyl-4-(propan-2-yloxymethoxy)tricyclo[7.6.1.02,7]hexadeca-2(7),3,5-trien-16-amine
CID 142351095
(1R,9S,15S)-1-methyl-4-phenylmethoxytricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-15-amine
CID 155036156
(4bS,8aS)-2,4b,8,8-tetramethyl-5,6,7,8a,9,10-hexahydrophenanthren-3-ol
CID 10515391
[(1R,9S,15S)-15-amino-1-methyl-4-tricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trienyl]oxymethyl 2,2-dimethylpropanoate
CID 138672555
[(1R,9S,15S)-15-amino-1-methyl-4-tricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trienyl] N-[2-(2-methoxyethoxy)ethyl]carbamate
CID 138671887
15-amino-1-methyl-6-phenyltricyclo[7.5.1.02,7]pentadeca-2,4,6-trien-4-ol
CID 139492246

Frequently Asked Questions

What is the IUPAC name of 15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol?
The IUPAC name of 15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol (CID 139492163) is 15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol.
What is the SMILES notation for 15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol?
The canonical SMILES for 15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol is Cc1cc2c(cc1O)C1(C)CCCCCC(C2)C1N.
What is the InChIKey of 15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol?
The InChIKey is OCGBACHWCXSEDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-11-8-13-9-12-6-4-3-5-7-17(2,16(12)18)14(13)10-15(11)19/h8,10,12,16,19H,3-7,9,18H2,1-2H3.
What are the key properties of 15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol?
15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol has a molecular weight of 259.39 g/mol, XLogP of 3.42, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 15-amino-1,5-dimethyltricyclo[7.5.1.02,7]pentadeca-2(7),3,5-trien-4-ol is sourced from PubChem (CID 139492163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).