(6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine

C14H19NO — CID 79247847

IUPAC(6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine
SMILESCOc1ccc2c(c1)C1(CCC2)CC1CN
InChIInChI=1S/C14H19NO/c1-16-12-5-4-10-3-2-6-14(13(10)7-12)8-11(14)9-15/h4-5,7,11H,2-3,6,8-9,15H2,1H3
InChIKeyVYLOIKZRFNOERM-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.25
Rot. Bonds2

About (6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine

(6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine (PubChem CID 79247847) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is (6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine.

Molecular Properties

Compound Name(6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine
PubChem CID79247847
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name(6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine
SMILESCOc1ccc2c(c1)C1(CCC2)CC1CN
InChIInChI=1S/C14H19NO/c1-16-12-5-4-10-3-2-6-14(13(10)7-12)8-11(14)9-15/h4-5,7,11H,2-3,6,8-9,15H2,1H3
InChIKeyVYLOIKZRFNOERM-UHFFFAOYSA-N
XLogP2.25
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methoxy-N-[(6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methyl]ethanamine
CID 79248469
(6-methoxyspiro[2,3-dihydrothiochromene-4,2'-cyclopropane]-1'-yl)methanamine
CID 105496966
2'-(bromomethyl)-5-methoxyspiro[1,2-dihydroindene-3,1'-cyclopropane]
CID 81351637
(1'R,3R)-5-methoxyspiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine
CID 97048142
1-(aminomethyl)-7-methoxy-N,N-dimethyl-3,4-dihydro-2H-naphthalen-1-amine
CID 79248766
1-(aminomethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79248291
N-[(5-methoxyspiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl)methyl]cyclopropanamine
CID 79374306
1-ethyl-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79240760
ethane;6-methoxy-4,4-dimethyl-2,3-dihydro-1H-naphthalene
CID 143044836
2-(7-methoxyspiro[3,4-dihydro-2H-naphthalene-1,1'-cyclopentane]-2-yl)acetic acid
CID 115057293
1-(aminomethyl)-N-(cyclobutylmethyl)-7-methoxy-N-methyl-3,4-dihydro-2H-naphthalen-1-amine
CID 79233197
[(1'S,3R)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yl]methanamine
CID 94557979

Frequently Asked Questions

What is the IUPAC name of (6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine?
The IUPAC name of (6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine (CID 79247847) is (6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine.
What is the SMILES notation for (6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine?
The canonical SMILES for (6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine is COc1ccc2c(c1)C1(CCC2)CC1CN.
What is the InChIKey of (6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine?
The InChIKey is VYLOIKZRFNOERM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-16-12-5-4-10-3-2-6-14(13(10)7-12)8-11(14)9-15/h4-5,7,11H,2-3,6,8-9,15H2,1H3.
What are the key properties of (6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine?
(6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine has a molecular weight of 217.31 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine is sourced from PubChem (CID 79247847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).