2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine

C16H25BrN2 — CID 63632200

IUPAC2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine
SMILESCCCN(CC)C1(CN)CCc2cc(Br)ccc2C1
InChIInChI=1S/C16H25BrN2/c1-3-9-19(4-2)16(12-18)8-7-13-10-15(17)6-5-14(13)11-16/h5-6,10H,3-4,7-9,11-12,18H2,1-2H3
InChIKeyRDDGFOSRBSEGHH-UHFFFAOYSA-N
MW325.29 g/mol
LogP3.37
Rot. Bonds5

About 2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine

2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine (PubChem CID 63632200) has the molecular formula C16H25BrN2 and a molecular weight of 325.29 g/mol. Its IUPAC name is 2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine.

Molecular Properties

Compound Name2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine
PubChem CID63632200
Molecular FormulaC16H25BrN2
Molecular Weight325.29 g/mol
Exact Mass324.12
IUPAC Name2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine
SMILESCCCN(CC)C1(CN)CCc2cc(Br)ccc2C1
InChIInChI=1S/C16H25BrN2/c1-3-9-19(4-2)16(12-18)8-7-13-10-15(17)6-5-14(13)11-16/h5-6,10H,3-4,7-9,11-12,18H2,1-2H3
InChIKeyRDDGFOSRBSEGHH-UHFFFAOYSA-N
XLogP3.37
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.29
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(aminomethyl)-6-bromo-N-ethyl-N-(2-methylbutyl)-3,4-dihydro-1H-naphthalen-2-amine
CID 79481522
2-(aminomethyl)-6-bromo-N-(cyclopropylmethyl)-N-methyl-3,4-dihydro-1H-naphthalen-2-amine
CID 63632717
2-(aminomethyl)-6-bromo-N-(furan-3-ylmethyl)-N-methyl-3,4-dihydro-1H-naphthalen-2-amine
CID 63631153
2-[6-bromo-2-(dimethylamino)-3,4-dihydro-1H-naphthalen-2-yl]acetic acid
CID 64527960
2-(aminomethyl)-N-ethyl-N-(2-ethylbutyl)-3,4-dihydro-1H-naphthalen-2-amine
CID 63471954
2-(aminomethyl)-6-bromo-N-prop-2-enyl-3,4-dihydro-1H-naphthalen-2-amine
CID 65385569
ethyl 2-(2-amino-6-bromo-3,4-dihydro-1H-naphthalen-2-yl)acetate
CID 79849161
2-[2-(1-aminoethyl)-6-bromo-3,4-dihydro-1H-naphthalen-2-yl]acetic acid
CID 66099185
6-bromo-2-[2-(dimethylamino)ethylamino]-3,4-dihydro-1H-naphthalene-2-carboxamide
CID 63630990
ethyl 6-bromo-2-(methylamino)-3,4-dihydro-1H-naphthalene-2-carboxylate
CID 63632055
[6-bromo-2-(2,6-dimethylmorpholin-4-yl)-3,4-dihydro-1H-naphthalen-2-yl]methanamine
CID 63630602
6-bromo-2-(propoxymethyl)-3,4-dihydro-1H-naphthalen-2-ol
CID 79567932

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine?
The IUPAC name of 2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine (CID 63632200) is 2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine.
What is the SMILES notation for 2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine?
The canonical SMILES for 2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine is CCCN(CC)C1(CN)CCc2cc(Br)ccc2C1.
What is the InChIKey of 2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine?
The InChIKey is RDDGFOSRBSEGHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25BrN2/c1-3-9-19(4-2)16(12-18)8-7-13-10-15(17)6-5-14(13)11-16/h5-6,10H,3-4,7-9,11-12,18H2,1-2H3.
What are the key properties of 2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine?
2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine has a molecular weight of 325.29 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-6-bromo-N-ethyl-N-propyl-3,4-dihydro-1H-naphthalen-2-amine is sourced from PubChem (CID 63632200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).