1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine

C17H26N2O — CID 79248601

IUPAC1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
SMILESCOc1ccc2c(c1)C(CN)(NCCC1CC1)CCC2
InChIInChI=1S/C17H26N2O/c1-20-15-7-6-14-3-2-9-17(12-18,16(14)11-15)19-10-8-13-4-5-13/h6-7,11,13,19H,2-5,8-10,12,18H2,1H3
InChIKeyMTTWFIWGGUDHDN-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.58
Rot. Bonds6

About 1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine

1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine (PubChem CID 79248601) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
PubChem CID79248601
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
SMILESCOc1ccc2c(c1)C(CN)(NCCC1CC1)CCC2
InChIInChI=1S/C17H26N2O/c1-20-15-7-6-14-3-2-9-17(12-18,16(14)11-15)19-10-8-13-4-5-13/h6-7,11,13,19H,2-5,8-10,12,18H2,1H3
InChIKeyMTTWFIWGGUDHDN-UHFFFAOYSA-N
XLogP2.58
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-7-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-naphthalen-1-amine
CID 79247744
1-(aminomethyl)-7-methoxy-N-prop-2-ynyl-3,4-dihydro-2H-naphthalen-1-amine
CID 79247899
1-(aminomethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79248291
1-(4-ethylcyclohexyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79233573
1-(aminomethyl)-7-methoxy-N,N-dimethyl-3,4-dihydro-2H-naphthalen-1-amine
CID 79248766
1-ethyl-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79240760
1-(aminomethyl)-N-(cyclobutylmethyl)-7-methoxy-N-methyl-3,4-dihydro-2H-naphthalen-1-amine
CID 79233197
(6-methoxyspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-yl)methanamine
CID 79247847
[6-methoxy-1-(methylamino)-2,3-dihydroinden-1-yl]methanol
CID 79375001
ethane;6-methoxy-4,4-dimethyl-2,3-dihydro-1H-naphthalene
CID 143044836
1-(3,4-dimethylcyclohexyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine
CID 79233577
methyl 1-(cyclopropylmethylamino)-6-methoxy-3,4-dihydro-2H-naphthalene-1-carboxylate
CID 61001121

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine?
The IUPAC name of 1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine (CID 79248601) is 1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine is COc1ccc2c(c1)C(CN)(NCCC1CC1)CCC2.
What is the InChIKey of 1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine?
The InChIKey is MTTWFIWGGUDHDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-20-15-7-6-14-3-2-9-17(12-18,16(14)11-15)19-10-8-13-4-5-13/h6-7,11,13,19H,2-5,8-10,12,18H2,1H3.
What are the key properties of 1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine?
1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine has a molecular weight of 274.41 g/mol, XLogP of 2.58, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(2-cyclopropylethyl)-7-methoxy-3,4-dihydro-2H-naphthalen-1-amine is sourced from PubChem (CID 79248601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).