N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide

C12H15NO2 — CID 18976441

IUPACN-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide
SMILESCOc1cccc2c1CC(NC=O)CC2
InChIInChI=1S/C12H15NO2/c1-15-12-4-2-3-9-5-6-10(13-8-14)7-11(9)12/h2-4,8,10H,5-7H2,1H3,(H,13,14)
InChIKeyGIDPMYYHJSLJSK-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.30
Rot. Bonds3

About N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide

N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide (PubChem CID 18976441) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide.

Molecular Properties

Compound NameN-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide
PubChem CID18976441
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC NameN-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide
SMILESCOc1cccc2c1CC(NC=O)CC2
InChIInChI=1S/C12H15NO2/c1-15-12-4-2-3-9-5-6-10(13-8-14)7-11(9)12/h2-4,8,10H,5-7H2,1H3,(H,13,14)
InChIKeyGIDPMYYHJSLJSK-UHFFFAOYSA-N
XLogP1.30
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-(cyclopropylmethyl)-8-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
CID 18331788
(2S)-8-methoxy-2-methyl-1,2,3,4-tetrahydronaphthalene
CID 67639312
(2R)-N-benzyl-8-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
CID 22866782
1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)-N-methylmethanamine
CID 112547016
ethane;5-methoxy-N-methyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 165394416
8-methoxy-N-(1-methoxypentan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 19377028
N-(2-bicyclo[2.2.1]heptanyl)-8-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine;hydrochloride
CID 19431028
N-[3-[(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]pentyl]methanesulfonamide
CID 19377065
(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine;hydrochloride
CID 19888691
N-[3-[(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]pentyl]methanesulfonamide;hydrochloride
CID 19377083
N,N-diethyl-3-[(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]pentanamide
CID 19377092
3-[(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]pentyl propaneperoxoate
CID 19377067

Frequently Asked Questions

What is the IUPAC name of N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide?
The IUPAC name of N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide (CID 18976441) is N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide.
What is the SMILES notation for N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide?
The canonical SMILES for N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide is COc1cccc2c1CC(NC=O)CC2.
What is the InChIKey of N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide?
The InChIKey is GIDPMYYHJSLJSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO2/c1-15-12-4-2-3-9-5-6-10(13-8-14)7-11(9)12/h2-4,8,10H,5-7H2,1H3,(H,13,14).
What are the key properties of N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide?
N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide has a molecular weight of 205.26 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)formamide is sourced from PubChem (CID 18976441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).